3-(2-chlorophenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-isoxazole-4-carboxamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C

InChI

InChI=1S/C22H22ClN3O4S/c1-3-31(28,29)26-11-10-15-8-9-17(12-16(15)13-26)24-22(27)20-14(2)30-25-21(20)18-6-4-5-7-19(18)23/h4-9,12H,3,10-11,13H2,1-2H3,(H,24,27)