1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole

Systemtic Name: 1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole Openeye Name: 1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole CAS Name: 1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole IUPAC Name: 1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole Traditional Name: 1-[(4-butyl-2-tert-butyl-1,3-dithian-2-yl)methyl]imidazole Formula: C16H28N2S2 MolecularWeight: 312.53692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCSC(S1)(CN2C=CN=C2)C(C)(C)C

Isomeric SMILES

CCCCC1CCSC(S1)(CN2C=CN=C2)C(C)(C)C

InChI

InChI=1S/C16H28N2S2/c1-5-6-7-14-8-11-19-16(20-14,15(2,3)4)12-18-10-9-17-13-18/h9-10,13-14H,5-8,11-12H2,1-4H3