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3-(cyclohexylcarbamoylamino)-1-(phenylmethyl)pyrazole-4-carboxylic acid

3-(cyclohexylcarbamoylamino)-1-(phenylmethyl)pyrazole-4-carboxylic acid

Systemtic Name:3-(cyclohexylcarbamoylamino)-1-(phenylmethyl)pyrazole-4-carboxylic acid
Openeye Name:1-benzyl-3-(cyclohexylcarbamoylamino)pyrazole-4-carboxylic acid
CAS Name:3-[[(cyclohexylamino)-oxomethyl]amino]-1-(phenylmethyl)-4-pyrazolecarboxylic acid
IUPAC Name:1-benzyl-3-(cyclohexylcarbamoylamino)pyrazole-4-carboxylic acid
Traditional Name:1-benzyl-3-(cyclohexylcarbamoylamino)pyrazole-4-carboxylic acid
Formula: C18H22N4O3
MolecularWeight: 342.39228
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=NN(C=C2C(=O)O)CC3=CC=CC=C3


Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=NN(C=C2C(=O)O)CC3=CC=CC=C3


InChI

InChI=1S/C18H22N4O3/c23-17(24)15-12-22(11-13-7-3-1-4-8-13)21-16(15)20-18(25)19-14-9-5-2-6-10-14/h1,3-4,7-8,12,14H,2,5-6,9-11H2,(H,23,24)(H2,19,20,21,25)


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