2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[(3-amino-4-oxo-2-quinazolinyl)thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[(3-amino-4-keto-quinazolin-2-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C17H15FN4O2S MolecularWeight: 358.390003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)F)N

InChI

InChI=1S/C17H15FN4O2S/c18-12-7-5-11(6-8-12)9-20-15(23)10-25-17-21-14-4-2-1-3-13(14)16(24)22(17)19/h1-8H,9-10,19H2,(H,20,23)