N-[5-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]pentyl]heptan-1-amine

Systemtic Name: N-[5-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]pentyl]heptan-1-amine Openeye Name: N-[5-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]pentyl]heptan-1-amine CAS Name: N-[5-[(5-phenyl-1H-imidazol-2-yl)thio]pentyl]-1-heptanamine IUPAC Name: N-[5-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]pentyl]heptan-1-amine Traditional Name: heptyl-[5-[(5-phenyl-1H-imidazol-2-yl)thio]pentyl]amine Formula: C21H33N3S MolecularWeight: 359.57182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCCCCCSC1=NC=C(N1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCNCCCCCSC1=NC=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C21H33N3S/c1-2-3-4-5-10-15-22-16-11-7-12-17-25-21-23-18-20(24-21)19-13-8-6-9-14-19/h6,8-9,13-14,18,22H,2-5,7,10-12,15-17H2,1H3,(H,23,24)