(4R)-6-methyl-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4R)-6-methyl-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4R)-N-(2-isopropylphenyl)-6-methyl-4-(3-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4R)-6-methyl-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4R)-6-methyl-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4R)-6-methyl-4-(3-nitrophenyl)-N-o-cumenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3C(C)C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3C(C)C

InChI

InChI=1S/C21H22N4O3S/c1-12(2)16-9-4-5-10-17(16)23-20(26)18-13(3)22-21(29)24-19(18)14-7-6-8-15(11-14)25(27)28/h4-12,19H,1-3H3,(H,23,26)(H2,22,24,29)/t19-/m1/s1