N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-4-(2-thienyl)butanamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-4-(2-thienyl)butyramide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)CCCC3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C20H27N3OS/c24-20(9-5-7-18-8-6-14-25-18)22-16-17-10-11-19(21-15-17)23-12-3-1-2-4-13-23/h6,8,10-11,14-15H,1-5,7,9,12-13,16H2,(H,22,24)