3-[(7-chloranylquinolin-4-yl)amino]-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-[(7-chloranylquinolin-4-yl)amino]-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-[(7-chloro-4-quinolyl)amino]-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-[(7-chloro-4-quinolinyl)amino]-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-[(7-chloroquinolin-4-yl)amino]-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-[(7-chloro-4-quinolyl)amino]-2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C25H16ClFN4O2S MolecularWeight: 490.936543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C3=CC=C(C=C3)F)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C3=CC=C(C=C3)F)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C25H16ClFN4O2S/c26-16-7-10-18-21(11-12-28-22(18)13-16)30-31-24(33)19-3-1-2-4-20(19)29-25(31)34-14-23(32)15-5-8-17(27)9-6-15/h1-13H,14H2,(H,28,30)