Vitas-M small molecule compound

1-(5-chloro-2-methoxyphenyl)-2-(4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-2-yl)guanidine

Catalog ID
STK130372
SMILES COc1ccc(cc1N/C(=N/c1nc(=O)c2c([nH]1)CCC2)/N)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H16ClN5O2 MW 333.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16ClN5O2/c1-23-12-6-5-8(16)7-11(12)18-14(17)21-15-19-10-4-2-3-9(10)13(22)20-15/h5-7H,2-4H2,1H3,(H4,17,18,19,20,21,22)
InChIKey
NRUNXFHPUPDVSZ-UHFFFAOYSA-N
Synonyms
522660-52-2
(E)1(5chloro2methoxyphenyl)2(4oxo4567tetrahydro1Hcyclopenta(d)pyrimidin2yl)guanidine
1(5chloro2methoxyphenyl)2(4oxo1567tetrahydrocyclopenta(d)pyrimidin2yl)guanidine
1(5chloro2methoxyphenyl)2(4oxo4567tetrahydro1Hcyclopenta(d)pyrimidin2yl)guanidine
1(5CHLORO2METHOXYPHENYL)3(4HYDROXY67DIHYDRO5HCYCLOPENTA(D)PYRIMIDIN2YL)GUANIDINE
522660522
COC1=C(C=C(C=C1)Cl)NC(=NC2=NC(=O)C3=C(N2)CCC3)N
COc1ccc(cc1NC(=Nc1nc(=O)c2c((nH)1)CCC2)N)Cl
InChI=1SC15H16ClN5O2c12312658(16)711(12)1814(17)211519104239(10)13(22)2015h57H24H21H3(H4171819202122)
MFCD03669063
ZINC02484474
ZINC03891436
ZINC12371135
ZINC2484474

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.