2-methyl-4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline chloride

Systemtic Name: 2-methyl-4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline chloride Openeye Name: 2-methyl-4-[4-[1-methyl-2-(3-methyl-2H-imidazol-1-yl)ethyl]-1,4-diazepan-1-yl]aniline chloride CAS Name: 2-methyl-4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline chloride IUPAC Name: 2-methyl-4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline chloride Traditional Name: [2-methyl-4-[4-[1-methyl-2-(3-methyl-4-imidazolin-1-yl)ethyl]-1,4-diazepan-1-yl]phenyl]amine chloride Formula: C19H31ClN5- MolecularWeight: 364.93594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCN(CC2)C(C)CN3CN(C=C3)C)N.[Cl-]

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCN(CC2)C(C)CN3CN(C=C3)C)N.[Cl-]

InChI

InChI=1S/C19H31N5.ClH/c1-16-13-18(5-6-19(16)20)24-8-4-7-23(11-12-24)17(2)14-22-10-9-21(3)15-22;/h5-6,9-10,13,17H,4,7-8,11-12,14-15,20H2,1-3H3;1H/p-1