4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate

C79H87N23O17 — CID 91499937

IUPAC4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate
SMILESCC(=O)Nc1cc(C(=O)Nc2cc(C(=O)Nc3cc(/C=C/C(=O)n4ccnc4)n(C)c3)n(C)c2)n(C)c1.CC(=O)Nc1cc(C(=O)On2nnc3ccccc32)n(C)c1.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(C)=O)cn3C)cn2C)cn1C.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NOO)cn2C)cn1C
InChIInChI=1S/C25H26N8O4.C24H28N6O5.C16H20N4O5.C14H13N5O3/c1-16(34)27-18-10-21(31(3)13-18)25(37)29-19-11-22(32(4)14-19)24(36)28-17-9-20(30(2)12-17)5-6-23(35)33-8-7-26-15-33;1-6-35-22(32)8-7-19-9-16(12-28(19)3)26-23(33)21-11-18(14-30(21)5)27-24(34)20-10-17(13-29(20)4)25-15(2)31;1-4-24-15(21)6-5-13-7-11(9-19(13)2)17-16(22)14-8-12(18-25-23)10-20(14)3;1-9(20)15-10-7-13(18(2)8-10)14(21)22-19-12-6-4-3-5-11(12)16-17-19/h5-15H,1-4H3,(H,27,34)(H,28,36)(H,29,37);7-14H,6H2,1-5H3,(H,25,31)(H,26,33)(H,27,34);5-10,18,23H,4H2,1-3H3,(H,17,22);3-8H,1-2H3,(H,15,20)/b6-5+;8-7+;6-5+;
InChIKeyPUPDAHYKAOCMMU-LIHIUEQCSA-N
MW1630.71 g/mol
LogP8.46
Rot. Bonds25

About 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate

4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate (PubChem CID 91499937) has the molecular formula C79H87N23O17 and a molecular weight of 1630.71 g/mol. Its IUPAC name is 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate.

Molecular Properties

Compound Name4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate
PubChem CID91499937
Molecular FormulaC79H87N23O17
Molecular Weight1630.71 g/mol
Exact Mass1629.67
IUPAC Name4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate
SMILESCC(=O)Nc1cc(C(=O)Nc2cc(C(=O)Nc3cc(/C=C/C(=O)n4ccnc4)n(C)c3)n(C)c2)n(C)c1.CC(=O)Nc1cc(C(=O)On2nnc3ccccc32)n(C)c1.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(C)=O)cn3C)cn2C)cn1C.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NOO)cn2C)cn1C
InChIInChI=1S/C25H26N8O4.C24H28N6O5.C16H20N4O5.C14H13N5O3/c1-16(34)27-18-10-21(31(3)13-18)25(37)29-19-11-22(32(4)14-19)24(36)28-17-9-20(30(2)12-17)5-6-23(35)33-8-7-26-15-33;1-6-35-22(32)8-7-19-9-16(12-28(19)3)26-23(33)21-11-18(14-30(21)5)27-24(34)20-10-17(13-29(20)4)25-15(2)31;1-4-24-15(21)6-5-13-7-11(9-19(13)2)17-16(22)14-8-12(18-25-23)10-20(14)3;1-9(20)15-10-7-13(18(2)8-10)14(21)22-19-12-6-4-3-5-11(12)16-17-19/h5-15H,1-4H3,(H,27,34)(H,28,36)(H,29,37);7-14H,6H2,1-5H3,(H,25,31)(H,26,33)(H,27,34);5-10,18,23H,4H2,1-3H3,(H,17,22);3-8H,1-2H3,(H,15,20)/b6-5+;8-7+;6-5+;
InChIKeyPUPDAHYKAOCMMU-LIHIUEQCSA-N
XLogP8.46
TPSA463.16 Ų
H-Bond Donors10
H-Bond Acceptors32
Rotatable Bonds25
Heavy Atoms119
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001630.71
LogP ≤ 58.46
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ester_of_HOBT', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate with MolForge

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Related Compounds

Ethyl 1-cyclohexyl-4-[[1-methyl-4-[3-[[1-methyl-4-[[1-(2,2,2-trifluoroethyl)imidazole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propanoylamino]imidazole-2-carbonyl]amino]pyrrole-2-carboxylate
CID 176296606
gamma-but-Im-Py-Py-Im-gamma-but-Py-Py-Im-Py-COOCH3
CID 16186198
gamma-but-Im-Py-Py-Py-gamma-but-Im-Py-Im-Py-COOCH3
CID 16186199
1-methyl-4-{[1-methyl-4-({1-methyl-4-[(1-methyl-1H-imidazole-2-carbonyl)-amino]-1H-imidazole-2-carbonyl}-amino)-1H-imidazole-2-carbonyl]-amino}-1H-pyrrole-2-carboxylic acid methyl ester
CID 20820657
4-[[4-[[4-[[4-[4-[[4-[[4-[[4-[[4-(4-Aminobutanoylamino)-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]butanoylamino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylimidazole-2-carbonyl]amino]-1-[2-[[2-[3-(dimethylamino)propylamino]-2-oxoethyl]amino]-2-oxoethyl]pyrrole-2-carboxylic acid
CID 53643486
4-[[4-[4-[[4-[[4-[[4-[(4-Acetamido-1-methylimidazole-2-carbonyl)amino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]butanoylamino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylic acid
CID 58944531
1,2-Dihydrotriazolo[4,5-b]pyridin-3-yl 4-[[4-[4-[[4-[[4-[[4-[(4-acetamido-1-methylimidazole-2-carbonyl)amino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]butanoylamino]-1-methylimidazole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylate
CID 58944537
benzyl N-[4-amino-1-[[2-[[[5-[[2-[[5-[[[4-[[2-[[5-[[5-[(5-formyl-1-methylpyrrol-3-yl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylimidazol-4-yl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butyl]amino]oxymethyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylimidazol-4-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]oxymethyl]-1-methylimidazol-4-yl]amino]-1-oxobutan-2-yl]carbamate
CID 89009546
benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrol-2-yl]prop-2-enoate
CID 91237632
[(2R,5R)-3-acetyloxy-5-[2-[3-[[4-[[4-[[4-[[methoxy-(1-methylpyrrol-2-yl)methyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]propylamino]-6-oxo-1H-purin-9-yl]oxolan-2-yl]methyl acetate
CID 143423603
benzotriazol-1-yl 1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxylate;tert-butyl N-[1-methyl-5-[[1-methyl-5-[3-[[1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carbonyl]amino]pyrrole-2-carbonyl]amino]propylcarbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamate;1-methyl-4-[[1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxylic acid
CID 158243618
Benzotriazol-1-yl 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylate;(2-methoxycarbonyl-1-methylimidazol-4-yl)azanium;(5-methoxycarbonyl-1-methylpyrrol-3-yl)azanium;methyl 1-methyl-4-nitroimidazole-2-carboxylate;methyl 1-methyl-4-nitropyrrole-2-carboxylate;1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]imidazole-2-carboxylic acid;1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylic acid;dichloride
CID 159061714

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate?
The IUPAC name of 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate (CID 91499937) is 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate.
What is the SMILES notation for 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate?
The canonical SMILES for 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate is CC(=O)Nc1cc(C(=O)Nc2cc(C(=O)Nc3cc(/C=C/C(=O)n4ccnc4)n(C)c3)n(C)c2)n(C)c1.CC(=O)Nc1cc(C(=O)On2nnc3ccccc32)n(C)c1.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(C)=O)cn3C)cn2C)cn1C.CCOC(=O)/C=C/c1cc(NC(=O)c2cc(NOO)cn2C)cn1C.
What is the InChIKey of 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate?
The InChIKey is PUPDAHYKAOCMMU-LIHIUEQCSA-N. The full InChI is InChI=1S/C25H26N8O4.C24H28N6O5.C16H20N4O5.C14H13N5O3/c1-16(34)27-18-10-21(31(3)13-18)25(37)29-19-11-22(32(4)14-19)24(36)28-17-9-20(30(2)12-17)5-6-23(35)33-8-7-26-15-33;1-6-35-22(32)8-7-19-9-16(12-28(19)3)26-23(33)21-11-18(14-30(21)5)27-24(34)20-10-17(13-29(20)4)25-15(2)31;1-4-24-15(21)6-5-13-7-11(9-19(13)2)17-16(22)14-8-12(18-25-23)10-20(14)3;1-9(20)15-10-7-13(18(2)8-10)14(21)22-19-12-6-4-3-5-11(12)16-17-19/h5-15H,1-4H3,(H,27,34)(H,28,36)(H,29,37);7-14H,6H2,1-5H3,(H,25,31)(H,26,33)(H,27,34);5-10,18,23H,4H2,1-3H3,(H,17,22);3-8H,1-2H3,(H,15,20)/b6-5+;8-7+;6-5+;.
What are the key properties of 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate?
4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate has a molecular weight of 1630.71 g/mol, XLogP of 8.46, 25 rotatable bonds, 10 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[5-[[5-[(E)-3-imidazol-1-yl-3-oxoprop-1-enyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide;benzotriazol-1-yl 4-acetamido-1-methylpyrrole-2-carboxylate;ethyl (E)-3-[4-[[4-[(4-acetamido-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate;ethyl (E)-3-[4-[[4-(hydroperoxyamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrol-2-yl]prop-2-enoate is sourced from PubChem (CID 91499937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).