7ZO

5-[(5-chloranylpyrimidin-4-yl)amino]-1,3-dihydroindol-2-one

Created:	2017-02-23
Last modified:	2017-05-24

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16 entries where 7ZO is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	0
Bond Count	29
Aromatic Bond Count	12

2D diagram of 7ZO

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Chemical Component Summary
Name	5-[(5-chloranylpyrimidin-4-yl)amino]-1,3-dihydroindol-2-one
Systematic Name (OpenEye OEToolkits)	5-[(5-chloranylpyrimidin-4-yl)amino]-1,3-dihydroindol-2-one
Formula	C₁₂ H₉ Cl N₄ O
Molecular Weight	260.679
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Clc1cncnc1Nc2ccc3NC(=O)Cc3c2
SMILES	OpenEye OEToolkits	2.0.6	c1cc2c(cc1Nc3c(cncn3)Cl)CC(=O)N2
Canonical SMILES	CACTVS	3.385	Clc1cncnc1Nc2ccc3NC(=O)Cc3c2
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1cc2c(cc1Nc3c(cncn3)Cl)CC(=O)N2
InChI	InChI	1.03	InChI=1S/C12H9ClN4O/c13-9-5-14-6-15-12(9)16-8-1-2-10-7(3-8)4-11(18)17-10/h1-3,5-6H,4H2,(H,17,18)(H,14,15,16)
InChIKey	InChI	1.03	XGLOINXVRYWOSM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	133516862
ChEMBL	CHEMBL4090952

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