N-[5-(4-butylpiperazin-1-yl)carbonyl-2-chloranyl-phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[5-(4-butylpiperazin-1-yl)carbonyl-2-chloranyl-phenyl]naphthalene-2-sulfonamide Openeye Name: N-[5-(4-butylpiperazine-1-carbonyl)-2-chloro-phenyl]naphthalene-2-sulfonamide CAS Name: N-[5-[(4-butyl-1-piperazinyl)-oxomethyl]-2-chlorophenyl]-2-naphthalenesulfonamide IUPAC Name: N-[5-(4-butylpiperazine-1-carbonyl)-2-chlorophenyl]naphthalene-2-sulfonamide Traditional Name: N-[5-(4-butylpiperazine-1-carbonyl)-2-chloro-phenyl]naphthalene-2-sulfonamide Formula: C25H28ClN3O3S MolecularWeight: 486.02612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28ClN3O3S/c1-2-3-12-28-13-15-29(16-14-28)25(30)21-9-11-23(26)24(18-21)27-33(31,32)22-10-8-19-6-4-5-7-20(19)17-22/h4-11,17-18,27H,2-3,12-16H2,1H3