5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,2,4-triazol-3-one

Systemtic Name: 5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,2,4-triazol-3-one Openeye Name: 5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,2,4-triazol-3-one CAS Name: 5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenyl-1-piperazinyl)propyl]-1,2,4-triazol-3-one IUPAC Name: 5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,2,4-triazol-3-one Traditional Name: 5-ethyl-4-(2-phenoxyethyl)-2-[3-(4-phenylpiperazino)propyl]-1,2,4-triazol-3-one Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)N1CCOC2=CC=CC=C2)CCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=O)N1CCOC2=CC=CC=C2)CCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N5O2/c1-2-24-26-30(25(31)29(24)20-21-32-23-12-7-4-8-13-23)15-9-14-27-16-18-28(19-17-27)22-10-5-3-6-11-22/h3-8,10-13H,2,9,14-21H2,1H3