3-(azepan-1-ylsulfonyl)-N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(5-chloro-2-thienyl)methyl]-N-ethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(5-chloro-2-thiophenyl)methyl]-N-ethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(5-chlorothiophen-2-yl)methyl]-N-ethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[(5-chloro-2-thienyl)methyl]-N-ethyl-benzamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H25ClN2O3S2/c1-2-22(15-17-10-11-19(21)27-17)20(24)16-8-7-9-18(14-16)28(25,26)23-12-5-3-4-6-13-23/h7-11,14H,2-6,12-13,15H2,1H3