N-cyclopropyl-2-(4-fluorophenyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-cyclopropyl-2-(4-fluorophenyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-cyclopropyl-2-(4-fluorophenyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-cyclopropyl-2-(4-fluorophenyl)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-cyclopropyl-2-(4-fluorophenyl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-cyclopropyl-2-(4-fluorophenyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C25H28FN3O2S MolecularWeight: 453.572123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=C(C=C3)F)C(=O)NC4CC4

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=C(C=C3)F)C(=O)NC4CC4

InChI

InChI=1S/C25H28FN3O2S/c1-2-3-4-7-16-29-24(31)20-8-5-6-9-21(20)28-25(29)32-22(23(30)27-19-14-15-19)17-10-12-18(26)13-11-17/h5-6,8-13,19,22H,2-4,7,14-16H2,1H3,(H,27,30)