4-[6-bromanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[6-bromanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[6-bromo-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[6-bromo-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]butanenitrile IUPAC Name: 4-[6-bromo-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[6-bromo-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]butyronitrile Formula: C17H14BrN3O2S MolecularWeight: 404.28096

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCCCC#N

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCCCC#N

InChI

InChI=1S/C17H14BrN3O2S/c18-12-5-6-15-14(10-12)16(22)21(11-13-4-3-8-23-13)17(20-15)24-9-2-1-7-19/h3-6,8,10H,1-2,9,11H2