3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2-chloroanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(2-chloroanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2-chloroanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2-chloroanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C22H25Cl2N3O4S MolecularWeight: 498.4226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Cl)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Cl)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H25Cl2N3O4S/c1-26(15-21(28)25-19-9-5-4-8-17(19)23)22(29)16-10-11-18(24)20(14-16)32(30,31)27-12-6-2-3-7-13-27/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H,25,28)