Name: Name:Anamecouldnotbegeneratedforthisstructure.
Brand: Angene
SKU: AG01DUMI
Rating: 90 (10 reviews)

Anamecouldnotbegeneratedforthisstructure.

CAS No.:

1459711-49-9

Catalog Number:

AG01DUMI

Molecular Formula:

C15H22N2O4S

Molecular Weight:

326.4112

Catalog Number:

AG01DUMI

Chemical Name:

Anamecouldnotbegeneratedforthisstructure.

CAS Number:

1459711-49-9

Molecular Formula:

C15H22N2O4S

Molecular Weight:

326.4112

MDL Number:

MFCD31803320

IUPAC Name:

tert-butyl N-[(2,4-dimethoxyphenyl)methylcarbamothioyl]carbamate

InChI:

InChI=1S/C15H22N2O4S/c1-15(2,3)21-14(18)17-13(22)16-9-10-6-7-11(19-4)8-12(10)20-5/h6-8H,9H2,1-5H3,(H2,16,17,18,22)

InChI Key:

YKASBVOVVBVBDX-UHFFFAOYSA-N

SMILES:

COc1cc(OC)ccc1CNC(=S)NC(=O)OC(C)(C)C

Complexity:

384

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

326.13g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

326.411g/mol

Monoisotopic Mass:

326.13g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1