2-methylpropyl 3,4-dimethyl-6-[3-(2-phenylmethoxyethanoylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 3,4-dimethyl-6-[3-(2-phenylmethoxyethanoylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 6-[3-[(2-benzyloxyacetyl)amino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-[3-[(1-oxo-2-phenylmethoxyethyl)amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3,4-dimethyl-6-[3-[(2-phenylmethoxyacetyl)amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(2-benzoxyacetyl)amino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NC(=O)COCC3=CC=CC=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NC(=O)COCC3=CC=CC=C3)C(=O)OCC(C)C

InChI

InChI=1S/C26H31N3O4S/c1-17(2)14-33-25(31)23-18(3)29(4)26(34)28-24(23)20-11-8-12-21(13-20)27-22(30)16-32-15-19-9-6-5-7-10-19/h5-13,17,24H,14-16H2,1-4H3,(H,27,30)(H,28,34)