1-[(4R)-4-(4-chloranyl-3-nitro-phenyl)-6-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[(4R)-4-(4-chloranyl-3-nitro-phenyl)-6-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[(4R)-4-(4-chloro-3-nitro-phenyl)-6-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[(4R)-4-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[(4R)-4-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[(4R)-4-(4-chloro-3-nitro-phenyl)-6-(p-tolyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(NC(=S)N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C([C@H](NC(=S)N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C19H16ClN3O3S/c1-10-3-5-12(6-4-10)17-16(11(2)24)18(22-19(27)21-17)13-7-8-14(20)15(9-13)23(25)26/h3-9,18H,1-2H3,(H2,21,22,27)/t18-/m1/s1