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

Systemtic Name: N-[4-[1-imidazol-1-yl-4-(4-methylphenyl)butan-2-yl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-(p-tolyl)propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-(4-methylphenyl)butan-2-yl]thio]phenyl]acetamide IUPAC Name: N-[4-[1-imidazol-1-yl-4-(4-methylphenyl)butan-2-yl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-(p-tolyl)propyl]thio]phenyl]acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H25N3OS/c1-17-3-5-19(6-4-17)7-10-22(15-25-14-13-23-16-25)27-21-11-8-20(9-12-21)24-18(2)26/h3-6,8-9,11-14,16,22H,7,10,15H2,1-2H3,(H,24,26)