2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[(3,4-dichlorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[(3,4-dichlorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[(3,4-dichlorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-N-[(3,4-dichlorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[(3,4-dichlorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-N-(3,4-dichlorobenzyl)-N-methyl-acetamide Formula: C20H30Cl2N4O3S MolecularWeight: 477.4482

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)CN2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)CN2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H30Cl2N4O3S/c1-23(15-17-6-7-18(21)19(22)14-17)20(27)16-24-10-12-26(13-11-24)30(28,29)25-8-4-2-3-5-9-25/h6-7,14H,2-5,8-13,15-16H2,1H3