4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzenecarboximidamide hydrochloride Openeye Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methyl-benzimidazol-2-yl]methylamino]benzamidine hydrochloride CAS Name: 4-[[5-(2,2-dimethyl-1-oxopropyl)-1-methyl-2-benzimidazolyl]methylamino]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]methylamino]benzenecarboximidamide hydrochloride Traditional Name: 4-[(1-methyl-5-pivaloyl-benzimidazol-2-yl)methylamino]benzamidine hydrochloride Formula: C21H26ClN5O MolecularWeight: 399.91704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C(=N)N)C.Cl

Isomeric SMILES

CC(C)(C)C(=O)C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C(=N)N)C.Cl

InChI

InChI=1S/C21H25N5O.ClH/c1-21(2,3)19(27)14-7-10-17-16(11-14)25-18(26(17)4)12-24-15-8-5-13(6-9-15)20(22)23;/h5-11,24H,12H2,1-4H3,(H3,22,23);1H