4-[3-[4-(3,5-diethylpyrazol-1-yl)-2,5-dimethyl-phenyl]prop-2-ynylamino]benzenecarboximidamide

Systemtic Name: 4-[3-[4-(3,5-diethylpyrazol-1-yl)-2,5-dimethyl-phenyl]prop-2-ynylamino]benzenecarboximidamide Openeye Name: 4-[3-[4-(3,5-diethylpyrazol-1-yl)-2,5-dimethyl-phenyl]prop-2-ynylamino]benzamidine CAS Name: 4-[3-[4-(3,5-diethyl-1-pyrazolyl)-2,5-dimethylphenyl]prop-2-ynylamino]benzenecarboximidamide IUPAC Name: 4-[3-[4-(3,5-diethylpyrazol-1-yl)-2,5-dimethylphenyl]prop-2-ynylamino]benzenecarboximidamide Traditional Name: 4-[3-[4-(3,5-diethylpyrazol-1-yl)-2,5-dimethyl-phenyl]prop-2-ynylamino]benzamidine Formula: C25H29N5 MolecularWeight: 399.53126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=C(C=C(C(=C2)C)C#CCNC3=CC=C(C=C3)C(=N)N)C)CC

Isomeric SMILES

CCC1=CC(=NN1C2=C(C=C(C(=C2)C)C#CCNC3=CC=C(C=C3)C(=N)N)C)CC

InChI

InChI=1S/C25H29N5/c1-5-21-16-23(6-2)30(29-21)24-15-17(3)20(14-18(24)4)8-7-13-28-22-11-9-19(10-12-22)25(26)27/h9-12,14-16,28H,5-6,13H2,1-4H3,(H3,26,27)