N-cyclopentyl-2-[(3-fluorophenyl)methylsulfanyl]-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: N-cyclopentyl-2-[(3-fluorophenyl)methylsulfanyl]-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-2-[(3-fluorophenyl)methylsulfanyl]-3-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: N-cyclopentyl-2-[(3-fluorophenyl)methylthio]-3-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-2-[(3-fluorophenyl)methylsulfanyl]-3-(2-methoxyethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: N-cyclopentyl-2-[(3-fluorobenzyl)thio]-4-keto-3-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C24H26FN3O3S MolecularWeight: 455.544943

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=CC(=CC=C4)F

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=CC(=CC=C4)F

InChI

InChI=1S/C24H26FN3O3S/c1-31-12-11-28-23(30)20-10-9-17(22(29)26-19-7-2-3-8-19)14-21(20)27-24(28)32-15-16-5-4-6-18(25)13-16/h4-6,9-10,13-14,19H,2-3,7-8,11-12,15H2,1H3,(H,26,29)