4-[[2-[(2-cyanophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[2-[(2-cyanophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 4-[[2-[(2-cyanophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]-N-(2-furylmethyl)cyclohexanecarboxamide CAS Name: 4-[[2-[(2-cyanophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]-N-(2-furanylmethyl)-1-cyclohexanecarboxamide IUPAC Name: 4-[[2-[(2-cyanophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide Traditional Name: 4-[[2-[(2-cyanobenzyl)thio]-4-keto-quinazolin-3-yl]methyl]-N-(2-furfuryl)cyclohexanecarboxamide Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4C#N)C(=O)NCC5=CC=CO5

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4C#N)C(=O)NCC5=CC=CO5

InChI

InChI=1S/C29H28N4O3S/c30-16-22-6-1-2-7-23(22)19-37-29-32-26-10-4-3-9-25(26)28(35)33(29)18-20-11-13-21(14-12-20)27(34)31-17-24-8-5-15-36-24/h1-10,15,20-21H,11-14,17-19H2,(H,31,34)