3-[7-chloranyl-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[7-chloranyl-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[7-chloro-4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[7-chloro-4-oxo-3-[[(2R)-2-oxolanyl]methyl]-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[7-chloro-4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[7-chloro-4-keto-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]thio]propionitrile Formula: C16H16ClN3O2S MolecularWeight: 349.83514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC#N

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC#N

InChI

InChI=1S/C16H16ClN3O2S/c17-11-4-5-13-14(9-11)19-16(23-8-2-6-18)20(15(13)21)10-12-3-1-7-22-12/h4-5,9,12H,1-3,7-8,10H2/t12-/m1/s1