2-[2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]thiophene-3-carboxamide Formula: C22H17FN4O3S2 MolecularWeight: 468.523783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=C(C=CS3)C(=O)N)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=C(C=CS3)C(=O)N)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN4O3S2/c23-14-7-5-13(6-8-14)11-27-21(30)15-3-1-2-4-17(15)25-22(27)32-12-18(28)26-20-16(19(24)29)9-10-31-20/h1-10H,11-12H2,(H2,24,29)(H,26,28)