methyl N-[5-bromanyl-3-(heptadecylcarbamoylsulfanyl)pentyl]-N-(oxan-2-yl)carbamate

Systemtic Name: methyl N-[5-bromanyl-3-(heptadecylcarbamoylsulfanyl)pentyl]-N-(oxan-2-yl)carbamate Openeye Name: methyl N-[5-bromo-3-(heptadecylcarbamoylsulfanyl)pentyl]-N-tetrahydropyran-2-yl-carbamate CAS Name: N-[5-bromo-3-[[(heptadecylamino)-oxomethyl]thio]pentyl]-N-(2-oxanyl)carbamic acid methyl ester IUPAC Name: methyl N-[5-bromo-3-(heptadecylcarbamoylsulfanyl)pentyl]-N-(oxan-2-yl)carbamate Traditional Name: N-[5-bromo-3-(heptadecylcarbamoylthio)pentyl]-N-tetrahydropyran-2-yl-carbamic acid methyl ester Formula: C30H57BrN2O4S MolecularWeight: 621.75358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC(=O)SC(CCN(C1CCCCO1)C(=O)OC)CCBr

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC(=O)SC(CCN(C1CCCCO1)C(=O)OC)CCBr

InChI

InChI=1S/C30H57BrN2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24-32-29(34)38-27(21-23-31)22-25-33(30(35)36-2)28-20-17-19-26-37-28/h27-28H,3-26H2,1-2H3,(H,32,34)