3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-(1-thiophen-2-ylethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-(1-thiophen-2-ylethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[1-(2-thienyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-methyl-N-(1-thiophen-2-ylethyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-(1-thiophen-2-ylethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[1-(2-thienyl)ethyl]benzamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C1=CC=CS1)N(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

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