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

Systemtic Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]methanesulfonamide Openeye Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methyl-phenyl]methanesulfonamide CAS Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-2-methylphenyl]methanesulfonamide IUPAC Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-methylphenyl]methanesulfonamide Traditional Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-2-methyl-phenyl]methanesulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O2S2/c1-16-15-17(7-8-19(16)23-29(2,26)27)9-10-24-11-13-25(14-12-24)21-18-5-3-4-6-20(18)28-22-21/h3-8,15,23H,9-14H2,1-2H3