ethyl 2-[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[(4R)-4-(4-butoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)NC3=C(C(=C(S3)C)C)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@@H]2C(=C(NC(=S)N2)C)C(=O)NC3=C(C(=C(S3)C)C)C(=O)OCC

InChI

InChI=1S/C25H31N3O4S2/c1-6-8-13-32-18-11-9-17(10-12-18)21-20(15(4)26-25(33)27-21)22(29)28-23-19(24(30)31-7-2)14(3)16(5)34-23/h9-12,21H,6-8,13H2,1-5H3,(H,28,29)(H2,26,27,33)/t21-/m1/s1