3-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[4-(cyclopropylamino)-2-quinazolinyl]thio]methyl]benzonitrile IUPAC Name: 3-[[4-(cyclopropylamino)quinazolin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[4-(cyclopropylamino)quinazolin-2-yl]thio]methyl]benzonitrile Formula: C19H16N4S MolecularWeight: 332.42214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=CC=CC=C32)SCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC1NC2=NC(=NC3=CC=CC=C32)SCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H16N4S/c20-11-13-4-3-5-14(10-13)12-24-19-22-17-7-2-1-6-16(17)18(23-19)21-15-8-9-15/h1-7,10,15H,8-9,12H2,(H,21,22,23)