2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-quinolin-5-yl-propanamide

Systemtic Name: 2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-quinolin-5-yl-propanamide Openeye Name: 2-[(5-isobutylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-quinolyl)propanamide CAS Name: 2-[[5-(2-methylpropylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-quinolin-5-ylpropanamide Traditional Name: 2-[[5-(isobutylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(5-quinolyl)propionamide Formula: C18H20N4OS3 MolecularWeight: 404.5726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)SC(C)C(=O)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CC(C)CSC1=NN=C(S1)SC(C)C(=O)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C18H20N4OS3/c1-11(2)10-24-17-21-22-18(26-17)25-12(3)16(23)20-15-8-4-7-14-13(15)6-5-9-19-14/h4-9,11-12H,10H2,1-3H3,(H,20,23)