[2-oxidanylidene-2-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate Openeye Name: [2-[(3-isopropoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrazolyl)-3-pyridinecarboxylic acid [2-oxo-2-[[3-[oxo(propan-2-yloxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[(3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrazol-1-ylnicotinic acid [2-[(3-isopropoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl] ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C23H24N4O5S/c1-14(2)32-23(30)19-15-7-3-4-9-17(15)33-21(19)26-18(28)13-31-22(29)16-8-5-10-24-20(16)27-12-6-11-25-27/h5-6,8,10-12,14H,3-4,7,9,13H2,1-2H3,(H,26,28)