(4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methylpyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methylpyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methylpyrazol-4-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methyl-4-pyrazolyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methylpyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-N-(3-chlorophenyl)-6-methyl-4-(1-methylpyrazol-4-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C16H16ClN5OS MolecularWeight: 361.84914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CN(N=C2)C)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1)C2=CN(N=C2)C)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H16ClN5OS/c1-9-13(15(23)20-12-5-3-4-11(17)6-12)14(21-16(24)19-9)10-7-18-22(2)8-10/h3-8,14H,1-2H3,(H,20,23)(H2,19,21,24)/t14-/m0/s1