1-(2-heptylsulfanyl-4-phenyl-butyl)imidazole

Systemtic Name: 1-(2-heptylsulfanyl-4-phenyl-butyl)imidazole Openeye Name: 1-(2-heptylsulfanyl-4-phenyl-butyl)imidazole CAS Name: 1-[2-(heptylthio)-4-phenylbutyl]imidazole IUPAC Name: 1-(2-heptylsulfanyl-4-phenylbutyl)imidazole Traditional Name: 1-[2-(heptylthio)-4-phenyl-butyl]imidazole Formula: C20H30N2S MolecularWeight: 330.5306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC(CCC1=CC=CC=C1)CN2C=CN=C2

Isomeric SMILES

CCCCCCCSC(CCC1=CC=CC=C1)CN2C=CN=C2

InChI

InChI=1S/C20H30N2S/c1-2-3-4-5-9-16-23-20(17-22-15-14-21-18-22)13-12-19-10-7-6-8-11-19/h6-8,10-11,14-15,18,20H,2-5,9,12-13,16-17H2,1H3