methyl 4-hexyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-hexyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-hexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-hexyl-2-[[1-oxo-2-(3-phenoxyphenyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-hexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-hexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C26H29NO4S MolecularWeight: 451.57776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CSC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCCCC1=CSC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H29NO4S/c1-3-4-5-7-12-20-18-32-25(24(20)26(29)30-2)27-23(28)17-19-11-10-15-22(16-19)31-21-13-8-6-9-14-21/h6,8-11,13-16,18H,3-5,7,12,17H2,1-2H3,(H,27,28)