N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4,5-trimethoxy-benzamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C22H30N2O4S/c1-26-19-12-17(13-20(27-2)21(19)28-3)22(25)23-14-18(16-8-11-29-15-16)24-9-6-4-5-7-10-24/h8,11-13,15,18H,4-7,9-10,14H2,1-3H3,(H,23,25)