methyl 3-[2-(2,4-dimethylphenyl)ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(2,4-dimethylphenyl)ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[[2-(2,4-dimethylphenyl)acetyl]amino]benzothiophene-2-carboxylate CAS Name: 3-[[2-(2,4-dimethylphenyl)-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(2,4-dimethylphenyl)acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[[2-(2,4-dimethylphenyl)acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC)C

InChI

InChI=1S/C20H19NO3S/c1-12-8-9-14(13(2)10-12)11-17(22)21-18-15-6-4-5-7-16(15)25-19(18)20(23)24-3/h4-10H,11H2,1-3H3,(H,21,22)