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

Systemtic Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-2-[(4-phenyl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-2-[(4-phenylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C22H24N6S3 MolecularWeight: 468.66116

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H24N6S3/c1-25-20(15-30-21-23-18-9-5-6-10-19(18)31-21)24-28(22(25)29)16-26-11-13-27(14-12-26)17-7-3-2-4-8-17/h2-10H,11-16H2,1H3