N-hexadecyl-2-[[1-(pyridin-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]aniline

Systemtic Name: N-hexadecyl-2-[[1-(pyridin-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]aniline Openeye Name: N-hexadecyl-2-[[1-(2-pyridylmethyl)imidazol-2-yl]sulfanylmethyl]aniline CAS Name: N-hexadecyl-2-[[[1-(2-pyridinylmethyl)-2-imidazolyl]thio]methyl]aniline IUPAC Name: N-hexadecyl-2-[[1-(pyridin-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]aniline Traditional Name: cetyl-[2-[[[1-(2-pyridylmethyl)imidazol-2-yl]thio]methyl]phenyl]amine Formula: C32H48N4S MolecularWeight: 520.81532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=CC=C1CSC2=NC=CN2CC3=CC=CC=N3

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=CC=C1CSC2=NC=CN2CC3=CC=CC=N3

InChI

InChI=1S/C32H48N4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24-34-31-22-16-15-20-29(31)28-37-32-35-25-26-36(32)27-30-21-17-19-23-33-30/h15-17,19-23,25-26,34H,2-14,18,24,27-28H2,1H3