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Summary

Name:	(3P)-2-tert-butyl-6-ethyl-4,5-diphenyl-3-(1H-tetrazol-5-yl)pyridine
Formula:	C24 H25 N5
Formal charge:	0
Formula weight:	383.489 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	(3P)-2-tert-butyl-6-ethyl-4,5-diphenyl-3-(1H-tetrazol-5-yl)pyridine
OpenEye OEToolkits	2.0.7	2-~{tert}-butyl-6-ethyl-4,5-diphenyl-3-(1~{H}-1,2,3,4-tetrazol-5-yl)pyridine

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	CC(C)(C)c1nc(CC)c(c2ccccc2)c(c1c1nnn[NH]1)c1ccccc1
InChI	InChI	1.06	InChI=1S/C24H25N5/c1-5-18-19(16-12-8-6-9-13-16)20(17-14-10-7-11-15-17)21(23-26-28-29-27-23)22(25-18)24(2,3)4/h6-15H,5H2,1-4H3,(H,26,27,28,29)
InChIKey	InChI	1.06	ZADOXTBXBOBHNJ-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	CCc1nc(c(c2[nH]nnn2)c(c3ccccc3)c1c4ccccc4)C(C)(C)C
SMILES	CACTVS	3.385	CCc1nc(c(c2[nH]nnn2)c(c3ccccc3)c1c4ccccc4)C(C)(C)C
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	CCc1c(c(c(c(n1)C(C)(C)C)c2[nH]nnn2)c3ccccc3)c4ccccc4
SMILES	OpenEye OEToolkits	2.0.7	CCc1c(c(c(c(n1)C(C)(C)C)c2[nH]nnn2)c3ccccc3)c4ccccc4

223532

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