N-[4-[3-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylpropyl]phenyl]ethanamide

Systemtic Name: N-[4-[3-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylpropyl]phenyl]ethanamide Openeye Name: N-[4-[3-[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylpropyl]phenyl]acetamide CAS Name: N-[4-[3-[[4-(5-chloro-2-thiophenyl)-1-(1-imidazolyl)butan-2-yl]thio]propyl]phenyl]acetamide IUPAC Name: N-[4-[3-[4-(5-chlorothiophen-2-yl)-1-imidazol-1-ylbutan-2-yl]sulfanylpropyl]phenyl]acetamide Traditional Name: N-[4-[3-[[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]thio]propyl]phenyl]acetamide Formula: C22H26ClN3OS2 MolecularWeight: 448.04434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CCCSC(CCC2=CC=C(S2)Cl)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CCCSC(CCC2=CC=C(S2)Cl)CN3C=CN=C3

InChI

InChI=1S/C22H26ClN3OS2/c1-17(27)25-19-6-4-18(5-7-19)3-2-14-28-21(15-26-13-12-24-16-26)9-8-20-10-11-22(23)29-20/h4-7,10-13,16,21H,2-3,8-9,14-15H2,1H3,(H,25,27)