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

Systemtic Name: 5-(isoquinolin-5-yloxymethyl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(2-isopropylthiazol-4-yl)methyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide CAS Name: 5-(5-isoquinolinyloxymethyl)-N-[(2-propan-2-yl-4-thiazolyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-(isoquinolin-5-yloxymethyl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[(2-isopropylthiazol-4-yl)methyl]-5-(5-isoquinolyloxymethyl)isoxazole-3-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CS1)CNC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC(C)C1=NC(=CS1)CNC(=O)C2=NOC(=C2)COC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H20N4O3S/c1-13(2)21-24-15(12-29-21)10-23-20(26)18-8-16(28-25-18)11-27-19-5-3-4-14-9-22-7-6-17(14)19/h3-9,12-13H,10-11H2,1-2H3,(H,23,26)