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

Systemtic Name: methyl 4-[3-cyclopropyl-4-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 4-[3-cyclopropyl-4-methyl-5-(phenylcarbamoyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 4-[5-[anilino(oxo)methyl]-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-cyclopropyl-4-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 4-[3-cyclopropyl-4-methyl-5-(phenylcarbamoyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3S/c1-14-19(21(27)24-17-6-4-3-5-7-17)20(25-23(30)26(14)18-12-13-18)15-8-10-16(11-9-15)22(28)29-2/h3-11,18,20H,12-13H2,1-2H3,(H,24,27)(H,25,30)