2-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[4-keto-2-[[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]methyl]quinazolin-3-yl]acetonitrile Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C21H19N5O2S/c1-28-13-12-25-18-9-5-4-8-17(18)24-21(25)29-14-19-23-16-7-3-2-6-15(16)20(27)26(19)11-10-22/h2-9H,11-14H2,1H3