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

Systemtic Name: N-[4-(1-imidazol-1-yl-4-phenyl-butan-2-yl)sulfanylphenyl]ethanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-phenyl-propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-phenylbutan-2-yl]thio]phenyl]acetamide IUPAC Name: N-[4-(1-imidazol-1-yl-4-phenylbutan-2-yl)sulfanylphenyl]acetamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-phenyl-propyl]thio]phenyl]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC(CCC2=CC=CC=C2)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC(CCC2=CC=CC=C2)CN3C=CN=C3

InChI

InChI=1S/C21H23N3OS/c1-17(25)23-19-8-11-20(12-9-19)26-21(15-24-14-13-22-16-24)10-7-18-5-3-2-4-6-18/h2-6,8-9,11-14,16,21H,7,10,15H2,1H3,(H,23,25)