2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-N-cyclopentyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-N-cyclopentyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-N-cyclopentyl-3-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-N-cyclopentyl-3-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-N-cyclopentyl-3-(2-methoxyethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-N-cyclopentyl-4-keto-3-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C24H25ClFN3O3S MolecularWeight: 489.990003

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=C(C=CC=C4Cl)F

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C24H25ClFN3O3S/c1-32-12-11-29-23(31)17-10-9-15(22(30)27-16-5-2-3-6-16)13-21(17)28-24(29)33-14-18-19(25)7-4-8-20(18)26/h4,7-10,13,16H,2-3,5-6,11-12,14H2,1H3,(H,27,30)