1-methyl-4-[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]piperidin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]piperidin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]-1-piperidyl]sulfonyl]pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[[[(3-methyl-2-benzofuranyl)-oxomethyl]hydrazo]-oxomethyl]-1-piperidinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[[(3-methyl-1-benzofuran-2-carbonyl)amino]carbamoyl]piperidin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]piperidino]sulfonyl-pyrrole-2-carboxamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C22H25N5O6S/c1-13-16-5-3-4-6-18(16)33-19(13)22(30)25-24-21(29)14-7-9-27(10-8-14)34(31,32)15-11-17(20(23)28)26(2)12-15/h3-6,11-12,14H,7-10H2,1-2H3,(H2,23,28)(H,24,29)(H,25,30)