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

Systemtic Name: N-[4-[[4-(4-cyanopyridin-2-yl)piperazin-1-yl]methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-ethanamide Openeye Name: N-[4-[[4-(4-cyano-2-pyridyl)piperazin-1-yl]methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-acetamide CAS Name: N-[4-[[4-(4-cyano-2-pyridinyl)-1-piperazinyl]methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]-N-cyclopropylacetamide IUPAC Name: N-[4-[[4-(4-cyanopyridin-2-yl)piperazin-1-yl]methyl]-5-sulfanylidene-1,3,4-thiadiazol-2-yl]-N-cyclopropylacetamide Traditional Name: N-[4-[[4-(4-cyano-2-pyridyl)piperazino]methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-acetamide Formula: C18H21N7OS2 MolecularWeight: 415.53564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N7OS2/c1-13(26)25(15-2-3-15)17-21-24(18(27)28-17)12-22-6-8-23(9-7-22)16-10-14(11-19)4-5-20-16/h4-5,10,15H,2-3,6-9,12H2,1H3