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

Systemtic Name: 4-(2-hydroxyethyl)-2-[(4-phenylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-(2-hydroxyethyl)-2-[(4-phenylpiperazin-1-yl)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-(2-hydroxyethyl)-2-[(4-phenyl-1-piperazinyl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-(2-hydroxyethyl)-2-[(4-phenylpiperazin-1-yl)methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-(2-hydroxyethyl)-2-[(4-phenylpiperazino)methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C20H24N6OS MolecularWeight: 396.50916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N(C(=N2)C3=CC=NC=C3)CCO)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CN2C(=S)N(C(=N2)C3=CC=NC=C3)CCO)C4=CC=CC=C4

InChI

InChI=1S/C20H24N6OS/c27-15-14-25-19(17-6-8-21-9-7-17)22-26(20(25)28)16-23-10-12-24(13-11-23)18-4-2-1-3-5-18/h1-9,27H,10-16H2