methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(4-tert-butylphenyl)-1-oxoprop-2-enyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-tert-butylphenyl)acryloyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=O)/C=C/C2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C22H27NO3S/c1-7-17-14(2)27-20(19(17)21(25)26-6)23-18(24)13-10-15-8-11-16(12-9-15)22(3,4)5/h8-13H,7H2,1-6H3,(H,23,24)/b13-10+