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

Systemtic Name: [5-acetamido-3,4-diacetyloxy-6-(1-hexylbenzimidazol-2-yl)sulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [5-acetamido-3,4-diacetoxy-6-(1-hexylbenzimidazol-2-yl)sulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [5-acetamido-3,4-diacetyloxy-6-[(1-hexyl-2-benzimidazolyl)thio]-2-oxanyl]methyl ester IUPAC Name: [5-acetamido-3,4-diacetyloxy-6-(1-hexylbenzimidazol-2-yl)sulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [5-acetamido-3,4-diacetoxy-6-[(1-hexylbenzimidazol-2-yl)thio]tetrahydropyran-2-yl]methyl ester Formula: C27H37N3O8S MolecularWeight: 563.66298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

InChI

InChI=1S/C27H37N3O8S/c1-6-7-8-11-14-30-21-13-10-9-12-20(21)29-27(30)39-26-23(28-16(2)31)25(37-19(5)34)24(36-18(4)33)22(38-26)15-35-17(3)32/h9-10,12-13,22-26H,6-8,11,14-15H2,1-5H3,(H,28,31)