methyl 1-carbamimidoyl-3-methyl-5-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: methyl 1-carbamimidoyl-3-methyl-5-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: methyl 5-benzyl-1-carbamimidoyl-3-methyl-pyrazole-4-carboxylate CAS Name: 1-carbamimidoyl-3-methyl-5-(phenylmethyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-1-carbamimidoyl-3-methylpyrazole-4-carboxylate Traditional Name: 1-amidino-5-benzyl-3-methyl-pyrazole-4-carboxylic acid methyl ester Formula: C14H16N4O2 MolecularWeight: 272.30244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC)CC2=CC=CC=C2)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC)CC2=CC=CC=C2)C(=N)N

InChI

InChI=1S/C14H16N4O2/c1-9-12(13(19)20-2)11(18(17-9)14(15)16)8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H3,15,16)