2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(3-chlorophenyl)propanamide

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(3-chlorophenyl)propanamide Openeye Name: 2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanyl-N-(3-chlorophenyl)propanamide CAS Name: 2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]-N-(3-chlorophenyl)propanamide IUPAC Name: 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(3-chlorophenyl)propanamide Traditional Name: 2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]-N-(3-chlorophenyl)propionamide Formula: C16H17ClN4O2S MolecularWeight: 364.84978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)Cl)SC2=NC(=O)C=C(N2CC=C)N

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)Cl)SC2=NC(=O)C=C(N2CC=C)N

InChI

InChI=1S/C16H17ClN4O2S/c1-3-7-21-13(18)9-14(22)20-16(21)24-10(2)15(23)19-12-6-4-5-11(17)8-12/h3-6,8-10H,1,7,18H2,2H3,(H,19,23)