N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-phenylsulfanyl-acetamide CAS Name: N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(phenylthio)acetamide IUPAC Name: N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-phenylsulfanylacetamide Traditional Name: N-[[7-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(phenylthio)acetamide Formula: C27H29N3O4S MolecularWeight: 491.60186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNC(=O)CSC3=CC=CC=C3)CC4=CC5=C(C(=C4)OC)OCO5

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNC(=O)CSC3=CC=CC=C3)CC4=CC5=C(C(=C4)OC)OCO5

InChI

InChI=1S/C27H29N3O4S/c1-18-23(13-29-26(31)16-35-21-6-4-3-5-7-21)22-8-9-30(15-20(22)12-28-18)14-19-10-24(32-2)27-25(11-19)33-17-34-27/h3-7,10-12H,8-9,13-17H2,1-2H3,(H,29,31)