ethyl 4-(4-ethylphenyl)-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethylphenyl)-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-benzyloxyphenyl)prop-2-enoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[1-oxo-3-(4-phenylmethoxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylphenyl)-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 2-[[3-(4-benzoxyphenyl)acryloyl]amino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C31H29NO4S MolecularWeight: 511.63126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C31H29NO4S/c1-3-22-10-15-25(16-11-22)27-21-37-30(29(27)31(34)35-4-2)32-28(33)19-14-23-12-17-26(18-13-23)36-20-24-8-6-5-7-9-24/h5-19,21H,3-4,20H2,1-2H3,(H,32,33)