N-[2-(3-fluoranylphenoxy)ethyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-(3-fluoranylphenoxy)ethyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-(3-fluorophenoxy)ethyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(3-fluorophenoxy)ethyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(3-fluorophenoxy)ethyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-(3-fluorophenoxy)ethyl]-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H16FN3O3S MolecularWeight: 373.401343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCCOC3=CC(=CC=C3)F)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCCOC3=CC(=CC=C3)F)NC1=S

InChI

InChI=1S/C18H16FN3O3S/c1-22-17(24)14-6-5-11(9-15(14)21-18(22)26)16(23)20-7-8-25-13-4-2-3-12(19)10-13/h2-6,9-10H,7-8H2,1H3,(H,20,23)(H,21,26)