[5-acetamido-3,4-diacetyloxy-6-(1-butylbenzimidazol-2-yl)sulfanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [5-acetamido-3,4-diacetyloxy-6-(1-butylbenzimidazol-2-yl)sulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [5-acetamido-3,4-diacetoxy-6-(1-butylbenzimidazol-2-yl)sulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [5-acetamido-3,4-diacetyloxy-6-[(1-butyl-2-benzimidazolyl)thio]-2-oxanyl]methyl ester IUPAC Name: [5-acetamido-3,4-diacetyloxy-6-(1-butylbenzimidazol-2-yl)sulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [5-acetamido-3,4-diacetoxy-6-[(1-butylbenzimidazol-2-yl)thio]tetrahydropyran-2-yl]methyl ester Formula: C25H33N3O8S MolecularWeight: 535.60982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

InChI

InChI=1S/C25H33N3O8S/c1-6-7-12-28-19-11-9-8-10-18(19)27-25(28)37-24-21(26-14(2)29)23(35-17(5)32)22(34-16(4)31)20(36-24)13-33-15(3)30/h8-11,20-24H,6-7,12-13H2,1-5H3,(H,26,29)