3,5-dimethyl-4-[(4-phenylmethoxyphenyl)methyl]pyrazole-1-carboximidamide hydrochloride

Systemtic Name: 3,5-dimethyl-4-[(4-phenylmethoxyphenyl)methyl]pyrazole-1-carboximidamide hydrochloride Openeye Name: 4-[(4-benzyloxyphenyl)methyl]-3,5-dimethyl-pyrazole-1-carboxamidine hydrochloride CAS Name: 3,5-dimethyl-4-[(4-phenylmethoxyphenyl)methyl]-1-pyrazolecarboximidamide hydrochloride IUPAC Name: 3,5-dimethyl-4-[(4-phenylmethoxyphenyl)methyl]pyrazole-1-carboximidamide hydrochloride Traditional Name: 4-(4-benzoxybenzyl)-3,5-dimethyl-pyrazole-1-carboxamidine hydrochloride Formula: C20H23ClN4O MolecularWeight: 370.87582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=N)N)C)CC2=CC=C(C=C2)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CC1=C(C(=NN1C(=N)N)C)CC2=CC=C(C=C2)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C20H22N4O.ClH/c1-14-19(15(2)24(23-14)20(21)22)12-16-8-10-18(11-9-16)25-13-17-6-4-3-5-7-17;/h3-11H,12-13H2,1-2H3,(H3,21,22);1H