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

Systemtic Name: 4-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylbutanenitrile Openeye Name: 4-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylbutanenitrile CAS Name: 4-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]butanenitrile IUPAC Name: 4-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 4-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]butyronitrile Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC#N

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC#N

InChI

InChI=1S/C17H19N3OS/c18-11-5-6-12-22-17-19-15-10-4-3-9-14(15)16(21)20(17)13-7-1-2-8-13/h3-4,9-10,13H,1-2,5-8,12H2