N-[(3-fluorophenyl)methyl]-N,3-dimethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N,3-dimethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-fluorobenzyl)-4-keto-N,3-dimethyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC(=CC=C3)F)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC(=CC=C3)F)NC1=S

InChI

InChI=1S/C18H16FN3O2S/c1-21(10-11-4-3-5-13(19)8-11)16(23)12-6-7-14-15(9-12)20-18(25)22(2)17(14)24/h3-9H,10H2,1-2H3,(H,20,25)