N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=NOC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=NOC(=C4)C

InChI

InChI=1S/C21H21N3O4S/c1-14-7-9-18(10-8-14)29(26,27)24-13-17-6-4-3-5-16(17)12-19(24)21(25)22-20-11-15(2)28-23-20/h3-11,19H,12-13H2,1-2H3,(H,22,23,25)