N-[5-[[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide

Systemtic Name: N-[5-[[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide Openeye Name: N-[5-[[3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide CAS Name: N-[5-[[3-(cyanomethyl)-4-oxo-2-quinazolinyl]methylthio]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide IUPAC Name: N-[5-[[3-(cyanomethyl)-4-oxoquinazolin-2-yl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide Traditional Name: N-[5-[[3-(cyanomethyl)-4-keto-quinazolin-2-yl]methylthio]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propionamide Formula: C19H18N6O2S2 MolecularWeight: 426.51522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C19H18N6O2S2/c1-2-16(26)25(12-7-8-12)18-22-23-19(29-18)28-11-15-21-14-6-4-3-5-13(14)17(27)24(15)10-9-20/h3-6,12H,2,7-8,10-11H2,1H3