2,6-dimethyl-5-[(phenylmethyl)amino]-1,2,4-triazin-3-one

Systemtic Name: 2,6-dimethyl-5-[(phenylmethyl)amino]-1,2,4-triazin-3-one Openeye Name: 5-(benzylamino)-2,6-dimethyl-1,2,4-triazin-3-one CAS Name: 2,6-dimethyl-5-[(phenylmethyl)amino]-1,2,4-triazin-3-one IUPAC Name: 5-(benzylamino)-2,6-dimethyl-1,2,4-triazin-3-one Traditional Name: 5-(benzylamino)-2,6-dimethyl-1,2,4-triazin-3-one Formula: C12H14N4O MolecularWeight: 230.26576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N=C1NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C(=O)N=C1NCC2=CC=CC=C2)C

InChI

InChI=1S/C12H14N4O/c1-9-11(14-12(17)16(2)15-9)13-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,13,14,17)