1-[4-[1-imidazol-1-yl-4-(5-methylfuran-2-yl)butan-2-yl]sulfanylphenyl]imidazole

Systemtic Name: 1-[4-[1-imidazol-1-yl-4-(5-methylfuran-2-yl)butan-2-yl]sulfanylphenyl]imidazole Openeye Name: 1-[4-[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-furyl)propyl]sulfanylphenyl]imidazole CAS Name: 1-[4-[[1-(1-imidazolyl)-4-(5-methyl-2-furanyl)butan-2-yl]thio]phenyl]imidazole IUPAC Name: 1-[4-[1-imidazol-1-yl-4-(5-methylfuran-2-yl)butan-2-yl]sulfanylphenyl]imidazole Traditional Name: 1-[4-[[1-(imidazol-1-ylmethyl)-3-(5-methyl-2-furyl)propyl]thio]phenyl]imidazole Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=CC=C(O1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H22N4OS/c1-17-2-5-19(26-17)6-9-21(14-24-12-10-22-15-24)27-20-7-3-18(4-8-20)25-13-11-23-16-25/h2-5,7-8,10-13,15-16,21H,6,9,14H2,1H3