3-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]propanenitrile IUPAC Name: 3-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]propionitrile Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCC#N

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCC#N

InChI

InChI=1S/C16H17N3OS/c17-10-5-11-21-16-18-14-9-4-3-8-13(14)15(20)19(16)12-6-1-2-7-12/h3-4,8-9,12H,1-2,5-7,11H2