3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[1-(5-methyl-2-thienyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-methyl-N-[1-(5-methyl-2-thiophenyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[1-(5-methyl-2-thienyl)ethyl]benzamide Formula: C21H27ClN2O3S2 MolecularWeight: 455.03368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O3S2/c1-15-8-11-19(28-15)16(2)23(3)21(25)17-9-10-18(22)20(14-17)29(26,27)24-12-6-4-5-7-13-24/h8-11,14,16H,4-7,12-13H2,1-3H3