N-hexyl-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide

Systemtic Name: N-hexyl-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide Openeye Name: N-hexyl-4-(1,4,5-triphenylimidazol-2-yl)sulfanyl-butanamide CAS Name: N-hexyl-4-[(1,4,5-triphenyl-2-imidazolyl)thio]butanamide IUPAC Name: N-hexyl-4-(1,4,5-triphenylimidazol-2-yl)sulfanylbutanamide Traditional Name: N-hexyl-4-[(1,4,5-triphenylimidazol-2-yl)thio]butyramide Formula: C31H35N3OS MolecularWeight: 497.6941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCNC(=O)CCCSC1=NC(=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H35N3OS/c1-2-3-4-14-23-32-28(35)22-15-24-36-31-33-29(25-16-8-5-9-17-25)30(26-18-10-6-11-19-26)34(31)27-20-12-7-13-21-27/h5-13,16-21H,2-4,14-15,22-24H2,1H3,(H,32,35)