N-[(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyleneamino]-2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(2-chloro-6-fluorophenyl)methylideneamino]-2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2-chloro-6-fluorophenyl)methylideneamino]-2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(2-chloro-6-fluoro-benzylidene)amino]-2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]acetamide Formula: C25H20ClFN4O3S MolecularWeight: 510.967703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C25H20ClFN4O3S/c1-2-34-17-12-10-16(11-13-17)31-24(33)18-6-3-4-9-22(18)29-25(31)35-15-23(32)30-28-14-19-20(26)7-5-8-21(19)27/h3-14H,2,15H2,1H3,(H,30,32)