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

Systemtic Name: 1-[[4-butyl-2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Openeye Name: 1-[[4-butyl-2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole CAS Name: 1-[[4-butyl-2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole IUPAC Name: 1-[[4-butyl-2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Traditional Name: 1-[[4-butyl-2-(3-phenylpropyl)-1,3-dithian-2-yl]methyl]imidazole Formula: C21H30N2S2 MolecularWeight: 374.6063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCSC(S1)(CCCC2=CC=CC=C2)CN3C=CN=C3

Isomeric SMILES

CCCCC1CCSC(S1)(CCCC2=CC=CC=C2)CN3C=CN=C3

InChI

InChI=1S/C21H30N2S2/c1-2-3-11-20-12-16-24-21(25-20,17-23-15-14-22-18-23)13-7-10-19-8-5-4-6-9-19/h4-6,8-9,14-15,18,20H,2-3,7,10-13,16-17H2,1H3