ethyl (5Z)-2-[(2-chlorophenyl)carbonylamino]-5-[(3-ethoxy-5-iodanyl-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-2-[(2-chlorophenyl)carbonylamino]-5-[(3-ethoxy-5-iodanyl-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-[(2-chlorobenzoyl)amino]-5-[(3-ethoxy-5-iodo-4-prop-2-ynoxy-phenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-[[(2-chlorophenyl)-oxomethyl]amino]-5-[(3-ethoxy-5-iodo-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-[(2-chlorobenzoyl)amino]-5-[(3-ethoxy-5-iodo-4-prop-2-ynoxyphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-[(2-chlorobenzoyl)amino]-5-(3-ethoxy-5-iodo-4-propargyloxy-benzylidene)-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C26H21ClINO6S MolecularWeight: 637.87051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)C(=C(S2)NC(=O)C3=CC=CC=C3Cl)C(=O)OCC)I)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)C(=C(S2)NC(=O)C3=CC=CC=C3Cl)C(=O)OCC)I)OCC#C

InChI

InChI=1S/C26H21ClINO6S/c1-4-11-35-23-18(28)12-15(13-19(23)33-5-2)14-20-22(30)21(26(32)34-6-3)25(36-20)29-24(31)16-9-7-8-10-17(16)27/h1,7-10,12-14H,5-6,11H2,2-3H3,(H,29,31)/b20-14-