1-(4-tert-butylphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-2-amine dihydrochloride

Systemtic Name: 1-(4-tert-butylphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-2-amine dihydrochloride Openeye Name: 1-(4-tert-butylphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-2-amine dihydrochloride CAS Name: 1-[(4-tert-butylphenyl)thio]-N-[3-(1-imidazolyl)propyl]-2-methyl-2-propanamine dihydrochloride IUPAC Name: 1-(4-tert-butylphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine dihydrochloride Traditional Name: [2-[(4-tert-butylphenyl)thio]-1,1-dimethyl-ethyl]-(3-imidazol-1-ylpropyl)amine dihydrochloride Formula: C20H33Cl2N3S MolecularWeight: 418.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(C)(C)NCCCN2C=CN=C2.Cl.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(C)(C)NCCCN2C=CN=C2.Cl.Cl

InChI

InChI=1S/C20H31N3S.2ClH/c1-19(2,3)17-7-9-18(10-8-17)24-15-20(4,5)22-11-6-13-23-14-12-21-16-23;;/h7-10,12,14,16,22H,6,11,13,15H2,1-5H3;2*1H