5-(azepan-1-ylsulfonyl)-N-[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-2-methoxy-N-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-2-methoxy-N-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dichloroanilino)-2-oxo-ethyl]-2-methoxy-N-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-(3,4-dichloroanilino)-2-oxoethyl]-2-methoxy-N-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dichloroanilino)-2-oxoethyl]-2-methoxy-N-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(3,4-dichloroanilino)-2-keto-ethyl]-2-methoxy-N-methyl-benzamide Formula: C23H27Cl2N3O5S MolecularWeight: 528.44858

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C23H27Cl2N3O5S/c1-27(15-22(29)26-16-7-9-19(24)20(25)13-16)23(30)18-14-17(8-10-21(18)33-2)34(31,32)28-11-5-3-4-6-12-28/h7-10,13-14H,3-6,11-12,15H2,1-2H3,(H,26,29)