5-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C23H19F3N4O3S MolecularWeight: 488.48217

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C23H19F3N4O3S/c1-2-11-29-21(33)14-7-3-4-8-15(14)28-22(29)34-13-20(32)30-17-10-6-5-9-16(17)27-19(31)12-18(30)23(24,25)26/h2-10,18H,1,11-13H2,(H,27,31)