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

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-[3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-benzyloxy-3-methoxy-phenyl)prop-2-enoylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[3-(3-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-[3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 2-[[3-(4-benzoxy-3-methoxy-phenyl)acryloyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C30H26FNO5S MolecularWeight: 531.594543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C30H26FNO5S/c1-3-36-30(34)28-24(22-11-13-23(31)14-12-22)19-38-29(28)32-27(33)16-10-20-9-15-25(26(17-20)35-2)37-18-21-7-5-4-6-8-21/h4-17,19H,3,18H2,1-2H3,(H,32,33)