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

Systemtic Name: 3-ethyl-4-oxidanylidene-2-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-4-oxo-2-thioxo-N-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-2-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-4-oxo-2-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-2-thioxo-N-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide Formula: C18H14F3N3O2S MolecularWeight: 393.38287

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)NC1=S

InChI

InChI=1S/C18H14F3N3O2S/c1-2-24-16(26)13-7-6-10(8-14(13)23-17(24)27)15(25)22-12-5-3-4-11(9-12)18(19,20)21/h3-9H,2H2,1H3,(H,22,25)(H,23,27)