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Summary

Name:	8-chloro-2-[(2S)-pyrrolidin-2-yl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Formula:	C14 H12 Cl N3 O2
Formal charge:	0
Formula weight:	289.717 Da
Component type:	NON-POLYMER

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	8-chloro-2-[(2S)-pyrrolidin-2-yl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
OpenEye OEToolkits	1.7.6	8-chloranyl-2-[(2S)-pyrrolidin-2-yl]-3H-[1]benzofuro[3,2-d]pyrimidin-4-one

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Clc4cc3c(oc1c3N=C(NC1=O)C2NCCC2)cc4
InChI	InChI	1.03	InChI=1S/C14H12ClN3O2/c15-7-3-4-10-8(6-7)11-12(20-10)14(19)18-13(17-11)9-2-1-5-16-9/h3-4,6,9,16H,1-2,5H2,(H,17,18,19)/t9-/m0/s1
InChIKey	InChI	1.03	JJWLXRKVUJDJKG-VIFPVBQESA-N
SMILES_CANONICAL	CACTVS	3.370	Clc1ccc2oc3C(=O)NC(=Nc3c2c1)[C@@H]4CCCN4
SMILES	CACTVS	3.370	Clc1ccc2oc3C(=O)NC(=Nc3c2c1)[CH]4CCCN4
SMILES_CANONICAL	OpenEye OEToolkits	1.7.6	c1cc2c(cc1Cl)c3c(o2)C(=O)NC(=N3)[C@@H]4CCCN4
SMILES	OpenEye OEToolkits	1.7.6	c1cc2c(cc1Cl)c3c(o2)C(=O)NC(=N3)C4CCCN4

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