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

Systemtic Name: 2-methylpropyl 3,4-dimethyl-6-[3-(naphthalen-2-ylcarbonylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 3,4-dimethyl-6-[3-(naphthalene-2-carbonylamino)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-[3-[[2-naphthalenyl(oxo)methyl]amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3,4-dimethyl-6-[3-(naphthalene-2-carbonylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3,4-dimethyl-6-[3-(2-naphthoylamino)phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)C(=O)OCC(C)C

InChI

InChI=1S/C28H29N3O3S/c1-17(2)16-34-27(33)24-18(3)31(4)28(35)30-25(24)21-10-7-11-23(15-21)29-26(32)22-13-12-19-8-5-6-9-20(19)14-22/h5-15,17,25H,16H2,1-4H3,(H,29,32)(H,30,35)