4-[(5-azanyl-4-oxidanyl-3,4-dihydro-2H-pyrrol-2-yl)carbonylamino]-N-[3,3-bis(azanyl)prop-2-enylidene]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[(5-azanyl-4-oxidanyl-3,4-dihydro-2H-pyrrol-2-yl)carbonylamino]-N-[3,3-bis(azanyl)prop-2-enylidene]-1H-pyrrole-2-carboxamide Openeye Name: 4-[(5-amino-4-hydroxy-3,4-dihydro-2H-pyrrole-2-carbonyl)amino]-N-(3,3-diaminoprop-2-enylidene)-1H-pyrrole-2-carboxamide CAS Name: 4-[[(5-amino-4-hydroxy-3,4-dihydro-2H-pyrrol-2-yl)-oxomethyl]amino]-N-(3,3-diaminoprop-2-enylidene)-1H-pyrrole-2-carboxamide IUPAC Name: 4-[(5-amino-4-hydroxy-3,4-dihydro-2H-pyrrole-2-carbonyl)amino]-N-(3,3-diaminoprop-2-enylidene)-1H-pyrrole-2-carboxamide Traditional Name: 4-[(5-amino-4-hydroxy-1-pyrroline-2-carbonyl)amino]-N-(3,3-diaminoprop-2-enylidene)-1H-pyrrole-2-carboxamide Formula: C13H17N7O3 MolecularWeight: 319.31918

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=NC1C(=O)NC2=CNC(=C2)C(=O)N=CC=C(N)N)N)O

Isomeric SMILES

C1C(C(=NC1C(=O)NC2=CNC(=C2)C(=O)N=CC=C(N)N)N)O

InChI

InChI=1S/C13H17N7O3/c14-10(15)1-2-17-12(22)7-3-6(5-18-7)19-13(23)8-4-9(21)11(16)20-8/h1-3,5,8-9,18,21H,4,14-15H2,(H2,16,20)(H,19,23)