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

Systemtic Name: methyl 3-[2-(4-butylphenyl)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(4-butylphenyl)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-(4-butylphenyl)-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(4-butylphenyl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(4-butylphenyl)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C18H21NO3S/c1-3-4-5-13-6-8-14(9-7-13)12-16(20)19-15-10-11-23-17(15)18(21)22-2/h6-11H,3-5,12H2,1-2H3,(H,19,20)