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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H27N3O4S/c1-19-11-12-22(35(32,33)28-18-20-7-3-2-4-8-20)17-23(19)27(31)30-15-13-21(14-16-30)26-29-24-9-5-6-10-25(24)34-26/h2-12,17,21,28H,13-16,18H2,1H3