2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]pyridine-3-carboxamide

Systemtic Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]pyridine-3-carboxamide Openeye Name: 2-[(5-methylisoxazol-3-yl)methylsulfanyl]-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]pyridine-3-carboxamide CAS Name: 2-[(5-methyl-3-isoxazolyl)methylthio]-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-pyridinecarboxamide IUPAC Name: 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]pyridine-3-carboxamide Traditional Name: N-[(2R)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C20H18N4O4S MolecularWeight: 410.44632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)SCC4=NOC(=C4)C

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)SCC4=NOC(=C4)C

InChI

InChI=1S/C20H18N4O4S/c1-11-8-14(24-28-11)10-29-20-15(4-3-7-21-20)19(26)22-13-5-6-17-16(9-13)23-18(25)12(2)27-17/h3-9,12H,10H2,1-2H3,(H,22,26)(H,23,25)/t12-/m1/s1