1-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-3-cyano-2-(2-methylbutan-2-yl)guanidine

Systemtic Name: 1-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-3-cyano-2-(2-methylbutan-2-yl)guanidine Openeye Name: 1-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-3-cyano-2-(1,1-dimethylpropyl)guanidine CAS Name: 1-[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]-3-cyano-2-(2-methylbutan-2-yl)guanidine IUPAC Name: 1-[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]-3-cyano-2-(2-methylbutan-2-yl)guanidine Traditional Name: 2-tert-amyl-1-[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]-3-cyano-guanidine Formula: C17H21ClN6 MolecularWeight: 344.84184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N=C(NC#N)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)(C)N=C(NC#N)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H21ClN6/c1-5-17(2,3)22-16(20-11-19)21-15-10-14(23-24(15)4)12-6-8-13(18)9-7-12/h6-10H,5H2,1-4H3,(H2,20,21,22)