N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

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