ethyl 6-tert-butyl-2-[(1-ethanoylpiperidin-4-yl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-tert-butyl-2-[(1-ethanoylpiperidin-4-yl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(1-acetylpiperidine-4-carbonyl)amino]-6-tert-butyl-benzothiophene-3-carboxylate CAS Name: 2-[[(1-acetyl-4-piperidinyl)-oxomethyl]amino]-6-tert-butyl-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1-acetylpiperidine-4-carbonyl)amino]-6-tert-butyl-1-benzothiophene-3-carboxylate Traditional Name: 2-[(1-acetylisonipecotoyl)amino]-6-tert-butyl-benzothiophene-3-carboxylic acid ethyl ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1C=CC(=C2)C(C)(C)C)NC(=O)C3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1C=CC(=C2)C(C)(C)C)NC(=O)C3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H30N2O4S/c1-6-29-22(28)19-17-8-7-16(23(3,4)5)13-18(17)30-21(19)24-20(27)15-9-11-25(12-10-15)14(2)26/h7-8,13,15H,6,9-12H2,1-5H3,(H,24,27)