4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-N-(3,4-dimethylphenyl)benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O4S/c1-18-7-10-22(17-19(18)2)29-35(32,33)23-11-8-21(9-12-23)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