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NVK

Summary
Name:1-(2-methyl-1,3-benzoxazol-6-yl)-3-(1,5-naphthyridin-4-yl)urea
Formula:C17 H13 N5 O2
Formal charge:0
Formula weight:319.317 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-(2-methyl-1,3-benzoxazol-6-yl)-3-(1,5-naphthyridin-4-yl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H13N5O2/c1-10-20-12-5-4-11(9-15(12)24-10)21-17(23)22-14-6-8-18-13-3-2-7-19-16(13)14/h2-9H,1H3,(H2,18,21,22,23)
InChIKeyInChI1.03AKMNUCBQGHFICM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1oc2cc(NC(=O)Nc3ccnc4cccnc34)ccc2n1
SMILESCACTVS3.385Cc1oc2cc(NC(=O)Nc3ccnc4cccnc34)ccc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1nc2ccc(cc2o1)NC(=O)Nc3ccnc4c3nccc4
SMILESOpenEye OEToolkits2.0.7Cc1nc2ccc(cc2o1)NC(=O)Nc3ccnc4c3nccc4

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PDB entries from 2024-07-17

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