Name: Name:4-amino-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbonitrile
Brand: Angene
SKU: AG01A7JX
Rating: 90 (10 reviews)

4-amino-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbonitrile

CAS No.:

1019014-31-3

Catalog Number:

AG01A7JX

Molecular Formula:

C7H7N3S2

Molecular Weight:

197.2806

Catalog Number:

AG01A7JX

Chemical Name:

4-amino-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbonitrile

CAS Number:

1019014-31-3

Molecular Formula:

C7H7N3S2

Molecular Weight:

197.2806

MDL Number:

MFCD09861267

IUPAC Name:

4-amino-3-prop-2-enyl-2-sulfanylidene-1,3-thiazole-5-carbonitrile

InChI:

InChI=1S/C7H7N3S2/c1-2-3-10-6(9)5(4-8)12-7(10)11/h2H,1,3,9H2

InChI Key:

XEZSZCKVEZGVGM-UHFFFAOYSA-N

SMILES:

Nc1c(sc(=S)n1CC=C)C#N

Complexity:

310

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.008g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.274g/mol

Monoisotopic Mass:

197.008g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

110A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7