2-cyano-3-[(4-ethylphenyl)amino]-3-[(3-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[(4-ethylphenyl)amino]-3-[(3-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)prop-2-enamide Openeye Name: 2-cyano-3-(4-ethylanilino)-3-[(3-fluorophenyl)methylsulfanyl]-N-(2-furylmethyl)prop-2-enamide CAS Name: 2-cyano-3-(4-ethylanilino)-3-[(3-fluorophenyl)methylthio]-N-(2-furanylmethyl)-2-propenamide IUPAC Name: 2-cyano-3-(4-ethylanilino)-3-[(3-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)prop-2-enamide Traditional Name: 2-cyano-3-(4-ethylanilino)-3-[(3-fluorobenzyl)thio]-N-(2-furfuryl)acrylamide Formula: C24H22FN3O2S MolecularWeight: 435.513783

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=C(C#N)C(=O)NCC2=CC=CO2)SCC3=CC(=CC=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=C(C#N)C(=O)NCC2=CC=CO2)SCC3=CC(=CC=C3)F

InChI

InChI=1S/C24H22FN3O2S/c1-2-17-8-10-20(11-9-17)28-24(31-16-18-5-3-6-19(25)13-18)22(14-26)23(29)27-15-21-7-4-12-30-21/h3-13,28H,2,15-16H2,1H3,(H,27,29)