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M0Z

Summary
Name:4-(carbamoylamino)-1-(7-methoxynaphthalen-1-yl)-1H-pyrazole-3-carboxamide
Formula:C16 H15 N5 O3
Formal charge:0
Formula weight:325.322 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-(carbamoylamino)-1-(7-methoxynaphthalen-1-yl)-1H-pyrazole-3-carboxamide
OpenEye OEToolkits1.7.64-(aminocarbonylamino)-1-(7-methoxynaphthalen-1-yl)pyrazole-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(N)Nc1cn(nc1C(=O)N)c2cccc3c2cc(OC)cc3
InChIInChI1.03InChI=1S/C16H15N5O3/c1-24-10-6-5-9-3-2-4-13(11(9)7-10)21-8-12(19-16(18)23)14(20-21)15(17)22/h2-8H,1H3,(H2,17,22)(H3,18,19,23)
InChIKeyInChI1.03RPIDLPZPJARENN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc2cccc(n3cc(NC(N)=O)c(n3)C(N)=O)c2c1
SMILESCACTVS3.385COc1ccc2cccc(n3cc(NC(N)=O)c(n3)C(N)=O)c2c1
SMILES_CANONICALOpenEye OEToolkits1.7.6COc1ccc2cccc(c2c1)n3cc(c(n3)C(=O)N)NC(=O)N
SMILESOpenEye OEToolkits1.7.6COc1ccc2cccc(c2c1)n3cc(c(n3)C(=O)N)NC(=O)N

223532

PDB entries from 2024-08-07

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