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

Systemtic Name: ethyl 5-ethyl-2-[3-(3-methoxy-4-propoxy-phenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[3-(3-methoxy-4-propoxy-phenyl)prop-2-enoylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[3-(3-methoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[3-(3-methoxy-4-propoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[3-(3-methoxy-4-propoxy-phenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=C(S2)CC)C(=O)OCC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=C(S2)CC)C(=O)OCC)OC

InChI

InChI=1S/C22H27NO5S/c1-5-12-28-18-10-8-15(13-19(18)26-4)9-11-20(24)23-21-17(22(25)27-7-3)14-16(6-2)29-21/h8-11,13-14H,5-7,12H2,1-4H3,(H,23,24)