ethyl (E)-2-cyano-3-[[4-(4-cyanophenoxy)phenyl]amino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[4-(4-cyanophenoxy)phenyl]amino]-3-methylsulfanyl-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-(4-cyanophenoxy)anilino]-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-[4-(4-cyanophenoxy)anilino]-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-(4-cyanophenoxy)anilino]-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(4-cyanophenoxy)anilino]-3-(methylthio)acrylic acid ethyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CC=C(C=C1)OC2=CC=C(C=C2)C#N)SC)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\NC1=CC=C(C=C1)OC2=CC=C(C=C2)C#N)/SC)/C#N

InChI

InChI=1S/C20H17N3O3S/c1-3-25-20(24)18(13-22)19(27-2)23-15-6-10-17(11-7-15)26-16-8-4-14(12-21)5-9-16/h4-11,23H,3H2,1-2H3/b19-18+