N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-3-methylsulfanyl-propanamide Openeye Name: N-[[2-(azocan-1-yl)-3-pyridyl]methyl]-3-methylsulfanyl-propanamide CAS Name: N-[[2-(1-azocanyl)-3-pyridinyl]methyl]-3-(methylthio)propanamide IUPAC Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-3-methylsulfanylpropanamide Traditional Name: N-[[2-(azocan-1-yl)-3-pyridyl]methyl]-3-(methylthio)propionamide Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NCC1=C(N=CC=C1)N2CCCCCCC2

Isomeric SMILES

CSCCC(=O)NCC1=C(N=CC=C1)N2CCCCCCC2

InChI

InChI=1S/C17H27N3OS/c1-22-13-9-16(21)19-14-15-8-7-10-18-17(15)20-11-5-3-2-4-6-12-20/h7-8,10H,2-6,9,11-14H2,1H3,(H,19,21)