(5-azanyl-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone

Systemtic Name: (5-azanyl-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone Openeye Name: (5-amino-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone CAS Name: (5-amino-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone IUPAC Name: (5-amino-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone Traditional Name: (5-amino-1,2,4-triazol-1-yl)-[4-methoxy-3-[(3-methylphenoxy)methyl]phenyl]methanone Formula: C18H18N4O3 MolecularWeight: 338.36052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=C(C=CC(=C2)C(=O)N3C(=NC=N3)N)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=C(C=CC(=C2)C(=O)N3C(=NC=N3)N)OC

InChI

InChI=1S/C18H18N4O3/c1-12-4-3-5-15(8-12)25-10-14-9-13(6-7-16(14)24-2)17(23)22-18(19)20-11-21-22/h3-9,11H,10H2,1-2H3,(H2,19,20,21)