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

Systemtic Name: 2-[2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(O2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

C1CC1C2=NN=C(O2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C16H13N5O2S/c17-7-8-21-13(18-12-4-2-1-3-11(12)15(21)22)9-24-16-20-19-14(23-16)10-5-6-10/h1-4,10H,5-6,8-9H2