N-[2-(azepan-1-ylcarbonyl)phenyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(phenylthio)propionamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S/c25-21(14-17-27-18-10-4-3-5-11-18)23-20-13-7-6-12-19(20)22(26)24-15-8-1-2-9-16-24/h3-7,10-13H,1-2,8-9,14-17H2,(H,23,25)