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

Systemtic Name: 2-[(4-phenylpiperazin-1-yl)methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[(4-phenylpiperazin-1-yl)methyl]-4-propyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[(4-phenyl-1-piperazinyl)methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-phenylpiperazin-1-yl)methyl]-4-propyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[(4-phenylpiperazino)methyl]-4-propyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C21H26N6S MolecularWeight: 394.53634

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CCCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C21H26N6S/c1-2-12-26-20(18-8-10-22-11-9-18)23-27(21(26)28)17-24-13-15-25(16-14-24)19-6-4-3-5-7-19/h3-11H,2,12-17H2,1H3