4-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-isoxazole CAS Name: 4-[[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[(1-p-phenetylbenzimidazol-2-yl)thio]methyl]isoxazole Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=C(ON=C4C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=C(ON=C4C)C

InChI

InChI=1S/C21H21N3O2S/c1-4-25-17-11-9-16(10-12-17)24-20-8-6-5-7-19(20)22-21(24)27-13-18-14(2)23-26-15(18)3/h5-12H,4,13H2,1-3H3