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

Systemtic Name: N-cyclopentyl-2-[(2-fluorophenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-2-[(2-fluorophenyl)methylsulfanyl]-3-isobutyl-4-oxo-quinazoline-7-carboxamide CAS Name: N-cyclopentyl-2-[(2-fluorophenyl)methylthio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-2-[(2-fluorophenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide Traditional Name: N-cyclopentyl-2-[(2-fluorobenzyl)thio]-3-isobutyl-4-keto-quinazoline-7-carboxamide Formula: C25H28FN3O2S MolecularWeight: 453.572123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=CC=CC=C4F

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N=C1SCC4=CC=CC=C4F

InChI

InChI=1S/C25H28FN3O2S/c1-16(2)14-29-24(31)20-12-11-17(23(30)27-19-8-4-5-9-19)13-22(20)28-25(29)32-15-18-7-3-6-10-21(18)26/h3,6-7,10-13,16,19H,4-5,8-9,14-15H2,1-2H3,(H,27,30)