N-[4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonylphenyl]-3,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonylphenyl]-3,4-dimethyl-benzenesulfonamide Openeye Name: N-[4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]phenyl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[4-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]phenyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]phenyl]-3,4-dimethyl-benzenesulfonamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4)C

InChI

InChI=1S/C27H27N3O4S/c1-18-7-12-23(17-19(18)2)35(32,33)29-22-10-8-21(9-11-22)27(31)30-15-13-20(14-16-30)26-28-24-5-3-4-6-25(24)34-26/h3-12,17,20,29H,13-16H2,1-2H3