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

Systemtic Name: 4-[(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]methyl]benzonitrile IUPAC Name: 4-[(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(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=C(C=C4)C#N

Isomeric SMILES

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

InChI

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