ethyl 2-[2-[(Z)-2,3-dithiophen-2-ylprop-2-enoyl]oxyethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(Z)-2,3-dithiophen-2-ylprop-2-enoyl]oxyethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(Z)-2,3-bis(2-thienyl)prop-2-enoyl]oxyacetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-methylphenyl)-2-[[1-oxo-2-[(Z)-1-oxo-2,3-dithiophen-2-ylprop-2-enoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(Z)-2,3-dithiophen-2-ylprop-2-enoyl]oxyacetyl]amino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(Z)-2,3-bis(2-thienyl)acryloyl]oxyacetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C28H25NO5S3 MolecularWeight: 551.6968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)COC(=O)C(=CC3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)COC(=O)/C(=C/C3=CC=CS3)/C4=CC=CS4

InChI

InChI=1S/C28H25NO5S3/c1-4-33-28(32)25-24(19-11-9-17(2)10-12-19)18(3)37-26(25)29-23(30)16-34-27(31)21(22-8-6-14-36-22)15-20-7-5-13-35-20/h5-15H,4,16H2,1-3H3,(H,29,30)/b21-15+