4-(4-piperazin-1-ylphenyl)-2-propyl-1,2,4-triazol-3-one

Systemtic Name: 4-(4-piperazin-1-ylphenyl)-2-propyl-1,2,4-triazol-3-one Openeye Name: 4-(4-piperazin-1-ylphenyl)-2-propyl-1,2,4-triazol-3-one CAS Name: 4-[4-(1-piperazinyl)phenyl]-2-propyl-1,2,4-triazol-3-one IUPAC Name: 4-(4-piperazin-1-ylphenyl)-2-propyl-1,2,4-triazol-3-one Traditional Name: 4-(4-piperazinophenyl)-2-propyl-1,2,4-triazol-3-one Formula: C15H21N5O MolecularWeight: 287.36014

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CCCN1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C15H21N5O/c1-2-9-20-15(21)19(12-17-20)14-5-3-13(4-6-14)18-10-7-16-8-11-18/h3-6,12,16H,2,7-11H2,1H3