ethyl 4-cyano-5-[3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[3-(4-benzyloxy-3-methoxy-phenyl)prop-2-enoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[3-(3-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[3-(4-benzoxy-3-methoxy-phenyl)acryloyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C26H24N2O5S MolecularWeight: 476.54416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C#N)C

InChI

InChI=1S/C26H24N2O5S/c1-4-32-26(30)24-17(2)20(15-27)25(34-24)28-23(29)13-11-18-10-12-21(22(14-18)31-3)33-16-19-8-6-5-7-9-19/h5-14H,4,16H2,1-3H3,(H,28,29)