(6S)-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: (6S)-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6S)-3-benzyl-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6S)-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6S)-3-benzyl-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6S)-3-benzyl-6-(4-cyanophenyl)-4-methyl-N-(4-nitrophenyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C26H21N5O3S MolecularWeight: 483.54164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H21N5O3S/c1-17-23(25(32)28-21-11-13-22(14-12-21)31(33)34)24(20-9-7-18(15-27)8-10-20)29-26(35)30(17)16-19-5-3-2-4-6-19/h2-14,24H,16H2,1H3,(H,28,32)(H,29,35)/t24-/m0/s1