Name: Name:(Z)-S-Benzo[d]thiazol-2-yl 2-(2-aminothiazol-4-yl)-2-((trityloxy)imino)ethanethioate
Brand: Angene
SKU: AG007Z1Y
Rating: 90 (10 reviews)

(Z)-S-Benzo[d]thiazol-2-yl 2-(2-aminothiazol-4-yl)-2-((trityloxy)imino)ethanethioate

CAS No.:

143183-03-3

Catalog Number:

AG007Z1Y

Molecular Formula:

C31H22N4O2S3

Molecular Weight:

578.7270

Catalog Number:

AG007Z1Y

Chemical Name:

(Z)-S-Benzo[d]thiazol-2-yl 2-(2-aminothiazol-4-yl)-2-((trityloxy)imino)ethanethioate

CAS Number:

143183-03-3

Molecular Formula:

C31H22N4O2S3

Molecular Weight:

578.7270

MDL Number:

MFCD09031261

IUPAC Name:

S-(1,3-benzothiazol-2-yl) (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-trityloxyiminoethanethioate

InChI:

InChI=1S/C31H22N4O2S3/c32-29-33-25(20-38-29)27(28(36)40-30-34-24-18-10-11-19-26(24)39-30)35-37-31(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-20H,(H2,32,33)/b35-27-

InChI Key:

UYVFYQGIARQHJC-LSWMGQQCSA-N

SMILES:

Nc1scc(n1)/C(=N/OC(c1ccccc1)(c1ccccc1)c1ccccc1)/C(=O)Sc1nc2c(s1)cccc2

EC Number:

700-114-7

Complexity:

827

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

578.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

578.723g/mol

Monoisotopic Mass:

578.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

172A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

8.8