N-[[3-methyl-7-(4-oxidanylidene-4-phenyl-butanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[[3-methyl-7-(4-oxidanylidene-4-phenyl-butanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide Openeye Name: N-[[3-methyl-7-(4-oxo-4-phenyl-butanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide CAS Name: N-[[7-(1,4-dioxo-4-phenylbutyl)-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(methylthio)benzamide IUPAC Name: N-[[3-methyl-7-(4-oxo-4-phenylbutanoyl)-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanylbenzamide Traditional Name: N-[[7-(4-keto-4-phenyl-butanoyl)-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(methylthio)benzamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC=CC=C3SC)C(=O)CCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC=CC=C3SC)C(=O)CCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3S/c1-19-24(17-30-28(34)23-10-6-7-11-26(23)35-2)22-14-15-31(18-21(22)16-29-19)27(33)13-12-25(32)20-8-4-3-5-9-20/h3-11,16H,12-15,17-18H2,1-2H3,(H,30,34)