2-ethyl-4-phenylazanyl-5-propyl-1,2,4-triazol-3-one

Systemtic Name: 2-ethyl-4-phenylazanyl-5-propyl-1,2,4-triazol-3-one Openeye Name: 4-anilino-2-ethyl-5-propyl-1,2,4-triazol-3-one CAS Name: 4-anilino-2-ethyl-5-propyl-1,2,4-triazol-3-one IUPAC Name: 4-anilino-2-ethyl-5-propyl-1,2,4-triazol-3-one Traditional Name: 4-anilino-2-ethyl-5-propyl-1,2,4-triazol-3-one Formula: C13H18N4O MolecularWeight: 246.30822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)N1NC2=CC=CC=C2)CC

Isomeric SMILES

CCCC1=NN(C(=O)N1NC2=CC=CC=C2)CC

InChI

InChI=1S/C13H18N4O/c1-3-8-12-15-16(4-2)13(18)17(12)14-11-9-6-5-7-10-11/h5-7,9-10,14H,3-4,8H2,1-2H3