4-[(phenylmethyl)amino]-2-propyl-1,2,4-triazol-3-one

Systemtic Name: 4-[(phenylmethyl)amino]-2-propyl-1,2,4-triazol-3-one Openeye Name: 4-(benzylamino)-2-propyl-1,2,4-triazol-3-one CAS Name: 4-[(phenylmethyl)amino]-2-propyl-1,2,4-triazol-3-one IUPAC Name: 4-(benzylamino)-2-propyl-1,2,4-triazol-3-one Traditional Name: 4-(benzylamino)-2-propyl-1,2,4-triazol-3-one Formula: C12H16N4O MolecularWeight: 232.28164

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N(C=N1)NCC2=CC=CC=C2

Isomeric SMILES

CCCN1C(=O)N(C=N1)NCC2=CC=CC=C2

InChI

InChI=1S/C12H16N4O/c1-2-8-15-12(17)16(10-14-15)13-9-11-6-4-3-5-7-11/h3-7,10,13H,2,8-9H2,1H3