5-(methylamino)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(methylamino)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(methylamino)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(methylamino)-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(methylamino)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(methylamino)-3-[[4-(2-pyrimidyl)piperazino]methyl]-1,3,4-thiadiazole-2-thione Formula: C12H17N7S2 MolecularWeight: 323.44028

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN(C(=S)S1)CN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CNC1=NN(C(=S)S1)CN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C12H17N7S2/c1-13-11-16-19(12(20)21-11)9-17-5-7-18(8-6-17)10-14-3-2-4-15-10/h2-4H,5-9H2,1H3,(H,13,16)