6-[(4-propan-2-ylphenyl)methyl]-3-(prop-2-enylamino)-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(prop-2-enylamino)-2H-1,2,4-triazin-5-one Openeye Name: 3-(allylamino)-6-[(4-isopropylphenyl)methyl]-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(prop-2-enylamino)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-propan-2-ylphenyl)methyl]-3-(prop-2-enylamino)-2H-1,2,4-triazin-5-one Traditional Name: 3-(allylamino)-6-(4-isopropylbenzyl)-2H-1,2,4-triazin-5-one Formula: C16H20N4O MolecularWeight: 284.3562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCC=C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NNC(=NC2=O)NCC=C

InChI

InChI=1S/C16H20N4O/c1-4-9-17-16-18-15(21)14(19-20-16)10-12-5-7-13(8-6-12)11(2)3/h4-8,11H,1,9-10H2,2-3H3,(H2,17,18,20,21)