2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-[7-chloro-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[[7-chloro-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-[7-chloro-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[[7-chloro-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C23H17ClN4O3S MolecularWeight: 464.92408

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C23H17ClN4O3S/c24-16-5-8-19-20(12-16)27-23(28(22(19)30)13-18-2-1-11-31-18)32-14-21(29)26-17-6-3-15(4-7-17)9-10-25/h1-8,11-12H,9,13-14H2,(H,26,29)