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Summary

Name:	4-(4-Methylpiperazin-1-yl)-N-(2-oxo-5-(pyridin-4-yl)-1,2-dihydropyridin-3-yl)benzamide
Formula:	C22 H23 N5 O2
Formal charge:	0
Formula weight:	389.45 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	4-(4-methylpiperazin-1-yl)-N-(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)benzamide
OpenEye OEToolkits	1.7.6	4-(4-methylpiperazin-1-yl)-N-(2-oxidanylidene-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C2NC=C(c1ccncc1)C=C2NC(=O)c3ccc(cc3)N4CCN(C)CC4
InChI	InChI	1.03	InChI=1S/C22H23N5O2/c1-26-10-12-27(13-11-26)19-4-2-17(3-5-19)21(28)25-20-14-18(15-24-22(20)29)16-6-8-23-9-7-16/h2-9,14-15H,10-13H2,1H3,(H,24,29)(H,25,28)
InChIKey	InChI	1.03	GPWFEKSGAWXQOP-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	CN1CCN(CC1)c2ccc(cc2)C(=O)NC3=CC(=CNC3=O)c4ccncc4
SMILES	CACTVS	3.385	CN1CCN(CC1)c2ccc(cc2)C(=O)NC3=CC(=CNC3=O)c4ccncc4
SMILES_CANONICAL	OpenEye OEToolkits	1.7.6	CN1CCN(CC1)c2ccc(cc2)C(=O)NC3=CC(=CNC3=O)c4ccncc4
SMILES	OpenEye OEToolkits	1.7.6	CN1CCN(CC1)c2ccc(cc2)C(=O)NC3=CC(=CNC3=O)c4ccncc4

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