5-piperazin-1-ylcarbonyl-3-[(2,4,6-trimethylphenyl)methylideneamino]-2H-1,2,3-triazol-4-one

Systemtic Name: 5-piperazin-1-ylcarbonyl-3-[(2,4,6-trimethylphenyl)methylideneamino]-2H-1,2,3-triazol-4-one Openeye Name: 5-(piperazine-1-carbonyl)-3-[(2,4,6-trimethylphenyl)methyleneamino]-2H-triazol-4-one CAS Name: 5-[oxo(1-piperazinyl)methyl]-3-[(2,4,6-trimethylphenyl)methylideneamino]-2H-triazol-4-one IUPAC Name: 5-(piperazine-1-carbonyl)-3-[(2,4,6-trimethylphenyl)methylideneamino]-2H-triazol-4-one Traditional Name: 5-(piperazine-1-carbonyl)-3-[(2,4,6-trimethylbenzylidene)amino]-2H-triazol-4-one Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=NN2C(=O)C(=NN2)C(=O)N3CCNCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C=NN2C(=O)C(=NN2)C(=O)N3CCNCC3)C

InChI

InChI=1S/C17H22N6O2/c1-11-8-12(2)14(13(3)9-11)10-19-23-17(25)15(20-21-23)16(24)22-6-4-18-5-7-22/h8-10,18,21H,4-7H2,1-3H3