3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide Openeye Name: N-(4-isopropylphenyl)-3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanamide CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-N-(4-propan-2-ylphenyl)propanamide Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)-N-p-cumenyl-propionamide Formula: C17H21N3O2S MolecularWeight: 331.43254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C17H21N3O2S/c1-10(2)12-4-6-13(7-5-12)19-15(21)9-8-14-11(3)18-17(23)20-16(14)22/h4-7,10H,8-9H2,1-3H3,(H,19,21)(H2,18,20,22,23)