methyl 2-[5-[(4-chloranyl-2-methoxy-phenyl)carbamoyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 2-[5-[(4-chloranyl-2-methoxy-phenyl)carbamoyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 2-[5-[(4-chloro-2-methoxy-phenyl)carbamoyl]-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 2-[5-[(4-chloro-2-methoxyanilino)-oxomethyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-[(4-chloro-2-methoxyphenyl)carbamoyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 2-[5-[(4-chloro-2-methoxy-phenyl)carbamoyl]-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2CC2)C3=CC=CC=C3C(=O)OC)C(=O)NC4=C(C=C(C=C4)Cl)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2CC2)C3=CC=CC=C3C(=O)OC)C(=O)NC4=C(C=C(C=C4)Cl)OC

InChI

InChI=1S/C24H24ClN3O4S/c1-13-20(22(29)26-18-11-8-14(25)12-19(18)31-2)21(27-24(33)28(13)15-9-10-15)16-6-4-5-7-17(16)23(30)32-3/h4-8,11-12,15,21H,9-10H2,1-3H3,(H,26,29)(H,27,33)