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

Systemtic Name: 4-[4-[[[3-(dimethylamino)phenyl]carbonylamino]carbamoyl]piperidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[[4-[[[3-(dimethylamino)benzoyl]amino]carbamoyl]-1-piperidyl]sulfonyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[[[[3-(dimethylamino)phenyl]-oxomethyl]hydrazo]-oxomethyl]-1-piperidinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[[[3-(dimethylamino)benzoyl]amino]carbamoyl]piperidin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[[[3-(dimethylamino)benzoyl]amino]carbamoyl]piperidino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C21H28N6O5S MolecularWeight: 476.54922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=O)C3=CC(=CC=C3)N(C)C

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=O)C3=CC(=CC=C3)N(C)C

InChI

InChI=1S/C21H28N6O5S/c1-25(2)16-6-4-5-15(11-16)21(30)24-23-20(29)14-7-9-27(10-8-14)33(31,32)17-12-18(19(22)28)26(3)13-17/h4-6,11-14H,7-10H2,1-3H3,(H2,22,28)(H,23,29)(H,24,30)