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

Systemtic Name: 3-[(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]methyl]benzonitrile Formula: C19H15N3OS MolecularWeight: 333.4069

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H15N3OS/c20-11-13-4-3-5-14(10-13)12-24-19-21-17-7-2-1-6-16(17)18(23)22(19)15-8-9-15/h1-7,10,15H,8-9,12H2