4-azanyl-N-[2-[bis(azanyl)methylideneamino]-1,1,2,2-tetradeuterio-ethyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-azanyl-N-[2-[bis(azanyl)methylideneamino]-1,1,2,2-tetradeuterio-ethyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-amino-1-methyl-N-(1,1,2,2-tetradeuterio-2-guanidino-ethyl)pyrrole-2-carboxamide CAS Name: 4-amino-1-methyl-N-[1,1,2,2-tetradeuterio-2-(diaminomethylideneamino)ethyl]-2-pyrrolecarboxamide IUPAC Name: 4-amino-1-methyl-N-[1,1,2,2-tetradeuterio-2-(diaminomethylideneamino)ethyl]pyrrole-2-carboxamide Traditional Name: 4-amino-1-methyl-N-(1,1,2,2-tetradeuterio-2-guanidino-ethyl)pyrrole-2-carboxamide Formula: C9H16N6O MolecularWeight: 228.287587

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCN=C(N)N)N

Isomeric SMILES

[2H]C([2H])(C([2H])([2H])N=C(N)N)NC(=O)C1=CC(=CN1C)N

InChI

InChI=1S/C9H16N6O/c1-15-5-6(10)4-7(15)8(16)13-2-3-14-9(11)12/h4-5H,2-3,10H2,1H3,(H,13,16)(H4,11,12,14)/i2D2,3D2