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

Systemtic Name: methyl 2-[5-(diethylcarbamoyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 2-[5-(diethylcarbamoyl)-3-(4-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 2-[5-[diethylamino(oxo)methyl]-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-(diethylcarbamoyl)-3-(4-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 2-[5-(diethylcarbamoyl)-3-(4-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(N(C(=S)NC1C2=CC=CC=C2C(=O)OC)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(N(C(=S)NC1C2=CC=CC=C2C(=O)OC)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C25H29N3O4S/c1-6-27(7-2)23(29)21-16(3)28(17-12-14-18(31-4)15-13-17)25(33)26-22(21)19-10-8-9-11-20(19)24(30)32-5/h8-15,22H,6-7H2,1-5H3,(H,26,33)