2-[[5-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[[5-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[5-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5-[1-(4-oxo-1H-quinazolin-2-yl)ethylthio]-1,3,4-thiadiazol-2-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5-[1-(4-oxo-1H-quinazolin-2-yl)ethylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[5-[1-(4-keto-1H-quinazolin-2-yl)ethylthio]-1,3,4-thiadiazol-2-yl]thio]-N-propyl-acetamide Formula: C17H19N5O2S3 MolecularWeight: 421.56006

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NN=C(S1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCNC(=O)CSC1=NN=C(S1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H19N5O2S3/c1-3-8-18-13(23)9-25-16-21-22-17(27-16)26-10(2)14-19-12-7-5-4-6-11(12)15(24)20-14/h4-7,10H,3,8-9H2,1-2H3,(H,18,23)(H,19,20,24)