4-(4-chlorophenyl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperazine-1-carboxamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]piperazine-1-carboxamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-[3-(2-oxo-1-azepanyl)propyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]piperazine-1-carboxamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-[3-(2-ketoazepan-1-yl)propyl]piperazine-1-carboxamide Formula: C20H29ClN4O4S MolecularWeight: 456.98666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H29ClN4O4S/c21-17-6-8-18(9-7-17)30(28,29)25-15-13-24(14-16-25)20(27)22-10-4-12-23-11-3-1-2-5-19(23)26/h6-9H,1-5,10-16H2,(H,22,27)