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

Systemtic Name: 4-azanyl-3-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[(4-phenyl-1-piperazinyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[(4-phenylpiperazin-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-[(4-phenylpiperazino)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H18N6S MolecularWeight: 290.38722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NNC(=S)N2N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=NNC(=S)N2N)C3=CC=CC=C3

InChI

InChI=1S/C13H18N6S/c14-19-12(15-16-13(19)20)10-17-6-8-18(9-7-17)11-4-2-1-3-5-11/h1-5H,6-10,14H2,(H,16,20)