2-[2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[(5-isobutylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[[5-(2-methylpropylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[[5-(isobutylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C17H17N5OS3 MolecularWeight: 403.54478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)SCC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CC(C)CSC1=NN=C(S1)SCC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C17H17N5OS3/c1-11(2)9-24-16-20-21-17(26-16)25-10-14-19-13-6-4-3-5-12(13)15(23)22(14)8-7-18/h3-6,11H,8-10H2,1-2H3