4,4-dimethyl-2,5-bis[[2-(2-methylpropyl)phenyl]methylsulfanyl]imidazole; methanamine

Systemtic Name: 4,4-dimethyl-2,5-bis[[2-(2-methylpropyl)phenyl]methylsulfanyl]imidazole; methanamine Openeye Name: 2,5-bis[(2-isobutylphenyl)methylsulfanyl]-4,4-dimethyl-imidazole; methanamine CAS Name: 4,4-dimethyl-2,5-bis[[2-(2-methylpropyl)phenyl]methylthio]imidazole; methanamine IUPAC Name: 4,4-dimethyl-2,5-bis[[2-(2-methylpropyl)phenyl]methylsulfanyl]imidazole; methanamine Traditional Name: 2,5-bis[(2-isobutylbenzyl)thio]-4,4-dimethyl-imidazole; methylamine Formula: C28H41N3S2 MolecularWeight: 483.77524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=CC=C1CSC2=NC(=NC2(C)C)SCC3=CC=CC=C3CC(C)C.CN

Isomeric SMILES

CC(C)CC1=CC=CC=C1CSC2=NC(=NC2(C)C)SCC3=CC=CC=C3CC(C)C.CN

InChI

InChI=1S/C27H36N2S2.CH5N/c1-19(2)15-21-11-7-9-13-23(21)17-30-25-27(5,6)29-26(28-25)31-18-24-14-10-8-12-22(24)16-20(3)4;1-2/h7-14,19-20H,15-18H2,1-6H3;2H2,1H3