N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[(4,5-dimethylthiazol-2-yl)methyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide CAS Name: N-[(4,5-dimethyl-2-thiazolyl)methyl]-5-(5-isoquinolinyloxymethyl)-3-isoxazolecarboxamide IUPAC Name: N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-5-(isoquinolin-5-yloxymethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[(4,5-dimethylthiazol-2-yl)methyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CNC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4)C

Isomeric SMILES

CC1=C(SC(=N1)CNC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4)C

InChI

InChI=1S/C20H18N4O3S/c1-12-13(2)28-19(23-12)10-22-20(25)17-8-15(27-24-17)11-26-18-5-3-4-14-9-21-7-6-16(14)18/h3-9H,10-11H2,1-2H3,(H,22,25)