4-[2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethyl]morpholine dihydrochloride

Systemtic Name: 4-[2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethyl]morpholine dihydrochloride Openeye Name: 4-[2-(1-benzyl-5-methoxy-benzimidazol-2-yl)sulfanylethyl]morpholine dihydrochloride CAS Name: 4-[2-[[5-methoxy-1-(phenylmethyl)-2-benzimidazolyl]thio]ethyl]morpholine dihydrochloride IUPAC Name: 4-[2-(1-benzyl-5-methoxybenzimidazol-2-yl)sulfanylethyl]morpholine dihydrochloride Traditional Name: 4-[2-[(1-benzyl-5-methoxy-benzimidazol-2-yl)thio]ethyl]morpholine dihydrochloride Formula: C21H27Cl2N3O2S MolecularWeight: 456.42898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N2)SCCN3CCOCC3)CC4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N2)SCCN3CCOCC3)CC4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C21H25N3O2S.2ClH/c1-25-18-7-8-20-19(15-18)22-21(24(20)16-17-5-3-2-4-6-17)27-14-11-23-9-12-26-13-10-23;;/h2-8,15H,9-14,16H2,1H3;2*1H