N-[4-[2-(1-imidazol-1-yl-4-thiophen-2-yl-butan-2-yl)sulfanylethyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(1-imidazol-1-yl-4-thiophen-2-yl-butan-2-yl)sulfanylethyl]phenyl]ethanamide Openeye Name: N-[4-[2-[1-(imidazol-1-ylmethyl)-3-(2-thienyl)propyl]sulfanylethyl]phenyl]acetamide CAS Name: N-[4-[2-[[1-(1-imidazolyl)-4-thiophen-2-ylbutan-2-yl]thio]ethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(1-imidazol-1-yl-4-thiophen-2-ylbutan-2-yl)sulfanylethyl]phenyl]acetamide Traditional Name: N-[4-[2-[[1-(imidazol-1-ylmethyl)-3-(2-thienyl)propyl]thio]ethyl]phenyl]acetamide Formula: C21H25N3OS2 MolecularWeight: 399.5727

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CCSC(CCC2=CC=CS2)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CCSC(CCC2=CC=CS2)CN3C=CN=C3

InChI

InChI=1S/C21H25N3OS2/c1-17(25)23-19-6-4-18(5-7-19)10-14-27-21(15-24-12-11-22-16-24)9-8-20-3-2-13-26-20/h2-7,11-13,16,21H,8-10,14-15H2,1H3,(H,23,25)