ethyl 6-methyl-4-naphthalen-1-yl-2-(phenylmethylsulfanyl)-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-4-naphthalen-1-yl-2-(phenylmethylsulfanyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-6-methyl-4-(1-naphthyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-methyl-4-(1-naphthalenyl)-2-(phenylmethylthio)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-6-methyl-4-naphthalen-1-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 2-(benzylthio)-6-methyl-4-(1-naphthyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC=CC3=CC=CC=C32)SCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC=CC3=CC=CC=C32)SCC4=CC=CC=C4)C

InChI

InChI=1S/C25H24N2O2S/c1-3-29-24(28)22-17(2)26-25(30-16-18-10-5-4-6-11-18)27-23(22)21-15-9-13-19-12-7-8-14-20(19)21/h4-15,23H,3,16H2,1-2H3,(H,26,27)