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

Systemtic Name: 3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-4-methyl-benzenesulfonamide Openeye Name: 3-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-4-methyl-benzenesulfonamide CAS Name: 3-[[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: 3-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-4-methylbenzenesulfonamide Traditional Name: 3-[3-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-4-methyl-benzenesulfonamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H21N3O4S/c1-13-8-9-15(28(21,25)26)11-16(13)20(24)23-10-4-5-14(12-23)19-22-17-6-2-3-7-18(17)27-19/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H2,21,25,26)