4-[2,3-bis(chloranyl)phenyl]sulfonyl-N-heptan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]sulfonyl-N-heptan-2-yl-piperazine-1-carboxamide Openeye Name: 4-(2,3-dichlorophenyl)sulfonyl-N-(1-methylhexyl)piperazine-1-carboxamide CAS Name: 4-(2,3-dichlorophenyl)sulfonyl-N-heptan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-(2,3-dichlorophenyl)sulfonyl-N-heptan-2-ylpiperazine-1-carboxamide Traditional Name: 4-(2,3-dichlorophenyl)sulfonyl-N-(1-methylhexyl)piperazine-1-carboxamide Formula: C18H27Cl2N3O3S MolecularWeight: 436.39628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C(=CC=C2)Cl)Cl

Isomeric SMILES

CCCCCC(C)NC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C(=CC=C2)Cl)Cl

InChI

InChI=1S/C18H27Cl2N3O3S/c1-3-4-5-7-14(2)21-18(24)22-10-12-23(13-11-22)27(25,26)16-9-6-8-15(19)17(16)20/h6,8-9,14H,3-5,7,10-13H2,1-2H3,(H,21,24)