N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]benzenesulfonamide

Systemtic Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]benzenesulfonamide Openeye Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]benzenesulfonamide CAS Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-2-methylphenyl]benzenesulfonamide IUPAC Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methylphenyl]benzenesulfonamide Traditional Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-2-methyl-phenyl]benzenesulfonamide Formula: C26H28N4O2S2 MolecularWeight: 492.65612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H28N4O2S2/c1-20-19-21(11-12-24(20)28-34(31,32)22-7-3-2-4-8-22)13-14-29-15-17-30(18-16-29)26-23-9-5-6-10-25(23)33-27-26/h2-12,19,28H,13-18H2,1H3