1-[4-[1-imidazol-1-yl-4-(4-methoxyphenyl)butan-2-yl]sulfanylphenyl]imidazole

Systemtic Name: 1-[4-[1-imidazol-1-yl-4-(4-methoxyphenyl)butan-2-yl]sulfanylphenyl]imidazole Openeye Name: 1-[4-[1-(imidazol-1-ylmethyl)-3-(4-methoxyphenyl)propyl]sulfanylphenyl]imidazole CAS Name: 1-[4-[[1-(1-imidazolyl)-4-(4-methoxyphenyl)butan-2-yl]thio]phenyl]imidazole IUPAC Name: 1-[4-[1-imidazol-1-yl-4-(4-methoxyphenyl)butan-2-yl]sulfanylphenyl]imidazole Traditional Name: 1-[4-[[1-(imidazol-1-ylmethyl)-3-(4-methoxyphenyl)propyl]thio]phenyl]imidazole Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C23H24N4OS/c1-28-21-7-2-19(3-8-21)4-9-23(16-26-14-12-24-17-26)29-22-10-5-20(6-11-22)27-15-13-25-18-27/h2-3,5-8,10-15,17-18,23H,4,9,16H2,1H3