N-(2-butylphenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride

Systemtic Name: N-(2-butylphenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride Openeye Name: N-(2-butylphenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride CAS Name: N-(2-butylphenyl)-4-methoxy-3-(1-piperazinyl)benzenesulfonamide hydrochloride IUPAC Name: N-(2-butylphenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide hydrochloride Traditional Name: N-(2-butylphenyl)-4-methoxy-3-piperazino-benzenesulfonamide hydrochloride Formula: C21H30ClN3O3S MolecularWeight: 439.9992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCNCC3.Cl

Isomeric SMILES

CCCCC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCNCC3.Cl

InChI

InChI=1S/C21H29N3O3S.ClH/c1-3-4-7-17-8-5-6-9-19(17)23-28(25,26)18-10-11-21(27-2)20(16-18)24-14-12-22-13-15-24;/h5-6,8-11,16,22-23H,3-4,7,12-15H2,1-2H3;1H