N-(3-iodanyl-4-methyl-phenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride Openeye Name: N-(3-iodo-4-methyl-phenyl)-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride CAS Name: N-(3-iodo-4-methylphenyl)-4-methoxy-3-(1-piperazinyl)benzenesulfonamide hydrochloride IUPAC Name: N-(3-iodo-4-methylphenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide hydrochloride Traditional Name: N-(3-iodo-4-methyl-phenyl)-4-methoxy-3-piperazino-benzenesulfonamide hydrochloride Formula: C18H23ClIN3O3S MolecularWeight: 523.81599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCNCC3)I.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N3CCNCC3)I.Cl

InChI

InChI=1S/C18H22IN3O3S.ClH/c1-13-3-4-14(11-16(13)19)21-26(23,24)15-5-6-18(25-2)17(12-15)22-9-7-20-8-10-22;/h3-6,11-12,20-21H,7-10H2,1-2H3;1H