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

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,4-diethoxy-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4-diethoxy-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-3,4-diethoxybenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-3,4-diethoxybenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4-diethoxy-benzamide Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)OCC

InChI

InChI=1S/C23H32N2O3S/c1-3-27-21-10-9-18(15-22(21)28-4-2)23(26)24-16-20(19-11-14-29-17-19)25-12-7-5-6-8-13-25/h9-11,14-15,17,20H,3-8,12-13,16H2,1-2H3,(H,24,26)