[4,5-diacetyloxy-6-(5-chloranyl-6-methylsulfanyl-benzimidazol-1-yl)oxan-3-yl] ethanoate

Systemtic Name: [4,5-diacetyloxy-6-(5-chloranyl-6-methylsulfanyl-benzimidazol-1-yl)oxan-3-yl] ethanoate Openeye Name: [4,5-diacetoxy-6-(5-chloro-6-methylsulfanyl-benzimidazol-1-yl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [4,5-diacetyloxy-6-[5-chloro-6-(methylthio)-1-benzimidazolyl]-3-oxanyl] ester IUPAC Name: [4,5-diacetyloxy-6-(5-chloro-6-methylsulfanylbenzimidazol-1-yl)oxan-3-yl] acetate Traditional Name: acetic acid [4,5-diacetoxy-6-[5-chloro-6-(methylthio)benzimidazol-1-yl]tetrahydropyran-3-yl] ester Formula: C19H21ClN2O7S MolecularWeight: 456.89724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C=NC3=CC(=C(C=C32)SC)Cl

Isomeric SMILES

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)N2C=NC3=CC(=C(C=C32)SC)Cl

InChI

InChI=1S/C19H21ClN2O7S/c1-9(23)27-15-7-26-19(18(29-11(3)25)17(15)28-10(2)24)22-8-21-13-5-12(20)16(30-4)6-14(13)22/h5-6,8,15,17-19H,7H2,1-4H3