2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropyl-acetamide CAS Name: 2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropylacetamide IUPAC Name: 2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropylacetamide Traditional Name: 2-[4-(2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N-cyclohexyl-N-cyclopropyl-acetamide Formula: C22H32ClN3O3S MolecularWeight: 454.02578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CC2)C(=O)CN3CCCN(CC3)S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)N(C2CC2)C(=O)CN3CCCN(CC3)S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H32ClN3O3S/c23-20-9-4-5-10-21(20)30(28,29)25-14-6-13-24(15-16-25)17-22(27)26(19-11-12-19)18-7-2-1-3-8-18/h4-5,9-10,18-19H,1-3,6-8,11-17H2