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

Systemtic Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-(phenylcarbamoyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 2-[5-[anilino(oxo)methyl]-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxyphenyl)-4-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-(phenylcarbamoyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3C(=O)OC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)OC)C3=CC=CC=C3C(=O)OC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4S/c1-17-23(25(31)28-18-9-5-4-6-10-18)24(21-11-7-8-12-22(21)26(32)34-3)29-27(35)30(17)19-13-15-20(33-2)16-14-19/h4-16,24H,1-3H3,(H,28,31)(H,29,35)