2-[6-bromanyl-3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[6-bromanyl-3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile Openeye Name: 2-[6-bromo-3-[2-(cyclohexen-1-yl)ethyl]-4-oxo-quinazolin-2-yl]sulfanylacetonitrile CAS Name: 2-[[6-bromo-3-[2-(1-cyclohexenyl)ethyl]-4-oxo-2-quinazolinyl]thio]acetonitrile IUPAC Name: 2-[6-bromo-3-[2-(cyclohexen-1-yl)ethyl]-4-oxoquinazolin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[6-bromo-3-[2-(cyclohexen-1-yl)ethyl]-4-keto-quinazolin-2-yl]thio]acetonitrile Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC#N

Isomeric SMILES

C1CCC(=CC1)CCN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC#N

InChI

InChI=1S/C18H18BrN3OS/c19-14-6-7-16-15(12-14)17(23)22(18(21-16)24-11-9-20)10-8-13-4-2-1-3-5-13/h4,6-7,12H,1-3,5,8,10-11H2