2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[(4-ethyl-1-piperazinyl)methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-ethylpiperazino)methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C20H24N6S MolecularWeight: 380.50976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N6S/c1-2-23-12-14-24(15-13-23)16-25-20(27)26(18-6-4-3-5-7-18)19(22-25)17-8-10-21-11-9-17/h3-11H,2,12-16H2,1H3