N-methyl-4-[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-methyl-4-[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-methyl-4-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-methyl-4-[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-methyl-4-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-methyl-4-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H19N5O3 MolecularWeight: 377.39656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H19N5O3/c1-21-19(26)18-11-25(16-4-2-3-5-17(16)28-18)20(27)15-8-6-14(7-9-15)10-24-13-22-12-23-24/h2-9,12-13,18H,10-11H2,1H3,(H,21,26)