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

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,5-dimethoxy-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,5-dimethoxy-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-3,5-dimethoxybenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-3,5-dimethoxybenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,5-dimethoxy-benzamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCC(C2=CSC=C2)N3CCCCCC3)OC

InChI

InChI=1S/C21H28N2O3S/c1-25-18-11-17(12-19(13-18)26-2)21(24)22-14-20(16-7-10-27-15-16)23-8-5-3-4-6-9-23/h7,10-13,15,20H,3-6,8-9,14H2,1-2H3,(H,22,24)