methyl 2-[5-[(3-methoxyphenyl)carbamoyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 2-[5-[(3-methoxyphenyl)carbamoyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 2-[5-[(3-methoxyphenyl)carbamoyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 2-[5-[(3-methoxyanilino)-oxomethyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-[(3-methoxyphenyl)carbamoyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 2-[5-[(3-methoxyphenyl)carbamoyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC=CC=C2C(=O)OC)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1C)C2=CC=CC=C2C(=O)OC)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H23N3O4S/c1-13-18(20(26)23-14-8-7-9-15(12-14)28-3)19(24-22(30)25(13)2)16-10-5-6-11-17(16)21(27)29-4/h5-12,19H,1-4H3,(H,23,26)(H,24,30)