N-[2-(aminocarbonylamino)-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-5-yl]-3-azanyl-6-[bis(azanyl)methylideneamino]hexanamide

Systemtic Name: N-[2-(aminocarbonylamino)-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-5-yl]-3-azanyl-6-[bis(azanyl)methylideneamino]hexanamide Openeye Name: 3-amino-6-guanidino-N-(6-oxo-2-ureido-4,5-dihydro-1H-pyrimidin-5-yl)hexanamide CAS Name: 3-amino-N-[2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)hexanamide IUPAC Name: 3-amino-N-[2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)hexanamide Traditional Name: 3-amino-6-guanidino-N-(6-keto-2-ureido-4,5-dihydro-1H-pyrimidin-5-yl)hexanamide Formula: C12H23N9O3 MolecularWeight: 341.36952

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC(=N1)NC(=O)N)NC(=O)CC(CCCN=C(N)N)N

Isomeric SMILES

C1C(C(=O)NC(=N1)NC(=O)N)NC(=O)CC(CCCN=C(N)N)N

InChI

InChI=1S/C12H23N9O3/c13-6(2-1-3-17-10(14)15)4-8(22)19-7-5-18-12(20-9(7)23)21-11(16)24/h6-7H,1-5,13H2,(H,19,22)(H4,14,15,17)(H4,16,18,20,21,23,24)