N-methyl-N-[[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]quinoline-8-sulfonamide

Systemtic Name: N-methyl-N-[[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]quinoline-8-sulfonamide Openeye Name: N-methyl-N-[[3-(p-tolyl)-4,5-dihydroisoxazol-5-yl]methyl]quinoline-8-sulfonamide CAS Name: N-methyl-N-[[3-(4-methylphenyl)-4,5-dihydroisoxazol-5-yl]methyl]-8-quinolinesulfonamide IUPAC Name: N-methyl-N-[[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]quinoline-8-sulfonamide Traditional Name: N-methyl-N-[[3-(p-tolyl)-2-isoxazolin-5-yl]methyl]quinoline-8-sulfonamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(C2)CN(C)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(C2)CN(C)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H21N3O3S/c1-15-8-10-16(11-9-15)19-13-18(27-23-19)14-24(2)28(25,26)20-7-3-5-17-6-4-12-22-21(17)20/h3-12,18H,13-14H2,1-2H3