2-methylpropyl 3-ethyl-4-methyl-6-[4-[(2-phenylcyclopropyl)carbonylamino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 3-ethyl-4-methyl-6-[4-[(2-phenylcyclopropyl)carbonylamino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 3-ethyl-4-methyl-6-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-methyl-6-[4-[[oxo-(2-phenylcyclopropyl)methyl]amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-ethyl-4-methyl-6-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-4-methyl-6-[4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NC(=O)C3CC3C4=CC=CC=C4)C(=O)OCC(C)C)C

Isomeric SMILES

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NC(=O)C3CC3C4=CC=CC=C4)C(=O)OCC(C)C)C

InChI

InChI=1S/C28H33N3O3S/c1-5-31-18(4)24(27(33)34-16-17(2)3)25(30-28(31)35)20-11-13-21(14-12-20)29-26(32)23-15-22(23)19-9-7-6-8-10-19/h6-14,17,22-23,25H,5,15-16H2,1-4H3,(H,29,32)(H,30,35)