2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-phenyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=CC=C4

InChI

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