N-cyclopropyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-cyclopropyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-cyclopropyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-cyclopropyl-N-[4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-cyclopropyl-N-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-cyclopropyl-N-[4-[[4-(2-pyrimidyl)piperazino]methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]acetamide Formula: C16H21N7OS2 MolecularWeight: 391.51424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1CC1)C2=NN(C(=S)S2)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(=O)N(C1CC1)C2=NN(C(=S)S2)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C16H21N7OS2/c1-12(24)23(13-3-4-13)15-19-22(16(25)26-15)11-20-7-9-21(10-8-20)14-17-5-2-6-18-14/h2,5-6,13H,3-4,7-11H2,1H3