methyl 4-[[2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[[2-[1-(1-benzofuran-2-ylcarbonyl)piperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[[2-[1-(benzofuran-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[[2-[1-[2-benzofuranyl(oxo)methyl]-4-piperidinyl]-4-thiazolyl]-oxomethyl]amino]-1-methyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[[2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[[2-[1-(benzofuran-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CN1C=C(C=C1C(=O)OC)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H24N4O5S/c1-28-13-17(12-19(28)25(32)33-2)26-22(30)18-14-35-23(27-18)15-7-9-29(10-8-15)24(31)21-11-16-5-3-4-6-20(16)34-21/h3-6,11-15H,7-10H2,1-2H3,(H,26,30)