5-methyl-4-(phenylmethyl)-2-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-methyl-4-(phenylmethyl)-2-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-methyl-2-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-methyl-4-(phenylmethyl)-2-[[4-(2-pyrazinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-methyl-2-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-methyl-2-[(4-pyrazin-2-ylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C19H23N7S MolecularWeight: 381.49782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C19H23N7S/c1-16-22-26(19(27)25(16)14-17-5-3-2-4-6-17)15-23-9-11-24(12-10-23)18-13-20-7-8-21-18/h2-8,13H,9-12,14-15H2,1H3