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

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-(2-mesyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methyl-isoxazole-4-carboxamide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=CC4=C(CCN(C4)S(=O)(=O)C)C=C3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=CC4=C(CCN(C4)S(=O)(=O)C)C=C3

InChI

InChI=1S/C21H20ClN3O4S/c1-13-19(20(24-29-13)17-5-3-4-6-18(17)22)21(26)23-16-8-7-14-9-10-25(30(2,27)28)12-15(14)11-16/h3-8,11H,9-10,12H2,1-2H3,(H,23,26)