2-(2-methylpropylsulfanyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-(2-methylpropylsulfanyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazole Openeye Name: 2-isobutylsulfanyl-5-[2-(3-pyridyl)quinazolin-4-yl]sulfanyl-1,3,4-thiadiazole CAS Name: 2-(2-methylpropylthio)-5-[[2-(3-pyridinyl)-4-quinazolinyl]thio]-1,3,4-thiadiazole IUPAC Name: 2-(2-methylpropylsulfanyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazole Traditional Name: 2-(isobutylthio)-5-[[2-(3-pyridyl)quinazolin-4-yl]thio]-1,3,4-thiadiazole Formula: C19H17N5S3 MolecularWeight: 411.56678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC(C)CSC1=NN=C(S1)SC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C19H17N5S3/c1-12(2)11-25-18-23-24-19(27-18)26-17-14-7-3-4-8-15(14)21-16(22-17)13-6-5-9-20-10-13/h3-10,12H,11H2,1-2H3