2-cyano-3-[(3-methoxyphenyl)amino]-3-sulfanylidene-N-[3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-cyano-3-[(3-methoxyphenyl)amino]-3-sulfanylidene-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-cyano-3-(3-methoxyanilino)-3-thioxo-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 2-cyano-3-(3-methoxyanilino)-3-sulfanylidene-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-cyano-3-(3-methoxyanilino)-3-sulfanylidene-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-cyano-3-(m-anisidino)-3-thioxo-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C18H14F3N3O2S MolecularWeight: 393.38287

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2S/c1-26-14-7-3-6-13(9-14)24-17(27)15(10-22)16(25)23-12-5-2-4-11(8-12)18(19,20)21/h2-9,15H,1H3,(H,23,25)(H,24,27)