(E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]amino]-2-methyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]amino]-2-methyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]amino]-2-methyl-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thiophenyl]amino]-2-methyl-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]amino]-2-methyl-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]amino]-4-keto-2-methyl-but-2-enoic acid Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C=C(C)C(=O)O)C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)/C=C(\C)/C(=O)O)C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H16N2O4S/c1-10(18(22)23)8-15(21)20-17-14(9-19)16(11(2)25-17)12-4-6-13(24-3)7-5-12/h4-8H,1-3H3,(H,20,21)(H,22,23)/b10-8+