N-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H25N3O3S2/c1-18-9-11-22(12-10-18)34(31,32)28-21-6-4-5-20(17-21)26(30)29-15-13-19(14-16-29)25-27-23-7-2-3-8-24(23)33-25/h2-12,17,19,28H,13-16H2,1H3