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

Systemtic Name: methyl 4-(4-bromophenyl)-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(E)-3-(4-tert-butylphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[(E)-3-(4-tert-butylphenyl)acryloyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C25H24BrNO3S MolecularWeight: 498.43196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C25H24BrNO3S/c1-25(2,3)18-10-5-16(6-11-18)7-14-21(28)27-23-22(24(29)30-4)20(15-31-23)17-8-12-19(26)13-9-17/h5-15H,1-4H3,(H,27,28)/b14-7+