5-(tert-butylamino)-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(tert-butylamino)-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(tert-butylamino)-3-[[4-(4-pyridylmethyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(tert-butylamino)-3-[[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(tert-butylamino)-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(tert-butylamino)-3-[[4-(4-pyridylmethyl)piperazino]methyl]-1,3,4-thiadiazole-2-thione Formula: C17H26N6S2 MolecularWeight: 378.55854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN(C(=S)S1)CN2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)NC1=NN(C(=S)S1)CN2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C17H26N6S2/c1-17(2,3)19-15-20-23(16(24)25-15)13-22-10-8-21(9-11-22)12-14-4-6-18-7-5-14/h4-7H,8-13H2,1-3H3,(H,19,20)