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

Systemtic Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]-3-methyl-benzenesulfonamide Openeye Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]-3-methyl-benzenesulfonamide CAS Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-2-methylphenyl]-3-methylbenzenesulfonamide IUPAC Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methylphenyl]-3-methylbenzenesulfonamide Traditional Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-2-methyl-phenyl]-3-methyl-benzenesulfonamide Formula: C27H30N4O2S2 MolecularWeight: 506.6827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=C(C=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=C(C=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54)C

InChI

InChI=1S/C27H30N4O2S2/c1-20-6-5-7-23(18-20)35(32,33)29-25-11-10-22(19-21(25)2)12-13-30-14-16-31(17-15-30)27-24-8-3-4-9-26(24)34-28-27/h3-11,18-19,29H,12-17H2,1-2H3