(2S)-5-azanyl-2-(1H-imidazol-5-ylmethyl)-3-oxidanylidene-1,2-dihydropyrrole-4-carboxamide

Systemtic Name: (2S)-5-azanyl-2-(1H-imidazol-5-ylmethyl)-3-oxidanylidene-1,2-dihydropyrrole-4-carboxamide Openeye Name: (2S)-5-amino-2-(1H-imidazol-5-ylmethyl)-3-oxo-1,2-dihydropyrrole-4-carboxamide CAS Name: (2S)-5-amino-2-(1H-imidazol-5-ylmethyl)-3-oxo-1,2-dihydropyrrole-4-carboxamide IUPAC Name: (2S)-5-amino-2-(1H-imidazol-5-ylmethyl)-3-oxo-1,2-dihydropyrrole-4-carboxamide Traditional Name: (5S)-2-amino-5-(1H-imidazol-5-ylmethyl)-4-keto-2-pyrroline-3-carboxamide Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC2C(=O)C(=C(N2)N)C(=O)N

Isomeric SMILES

C1=C(NC=N1)C[C@H]2C(=O)C(=C(N2)N)C(=O)N

InChI

InChI=1S/C9H11N5O2/c10-8-6(9(11)16)7(15)5(14-8)1-4-2-12-3-13-4/h2-3,5,14H,1,10H2,(H2,11,16)(H,12,13)/t5-/m0/s1