N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-4-phenyl-oxane-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-4-phenyl-oxane-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-4-phenyl-4-oxanecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-4-phenyloxane-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-4-phenyl-tetrahydropyran-4-carboxamide Formula: C24H32N2O2S MolecularWeight: 412.58808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2(CCOCC2)C3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2(CCOCC2)C3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C24H32N2O2S/c27-23(24(11-15-28-16-12-24)21-8-4-3-5-9-21)25-18-22(20-10-17-29-19-20)26-13-6-1-2-7-14-26/h3-5,8-10,17,19,22H,1-2,6-7,11-16,18H2,(H,25,27)