3-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[7-chloro-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[7-chloro-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[7-chloro-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[7-chloro-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]propionitrile Formula: C16H12ClN3O2S MolecularWeight: 345.80338

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC#N

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCCC#N

InChI

InChI=1S/C16H12ClN3O2S/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/h1,3-5,7,9H,2,8,10H2