[3-[ethanoyl(heptadecyl)carbamoyl]sulfanyloxan-2-yl]methyl N-(pyridin-2-ylmethyl)carbamate

Systemtic Name: [3-[ethanoyl(heptadecyl)carbamoyl]sulfanyloxan-2-yl]methyl N-(pyridin-2-ylmethyl)carbamate Openeye Name: [3-[acetyl(heptadecyl)carbamoyl]sulfanyltetrahydropyran-2-yl]methyl N-(2-pyridylmethyl)carbamate CAS Name: N-(2-pyridinylmethyl)carbamic acid [3-[[[acetyl(heptadecyl)amino]-oxomethyl]thio]-2-oxanyl]methyl ester IUPAC Name: [3-[acetyl(heptadecyl)carbamoyl]sulfanyloxan-2-yl]methyl N-(pyridin-2-ylmethyl)carbamate Traditional Name: N-(2-pyridylmethyl)carbamic acid [3-[[acetyl(heptadecyl)carbamoyl]thio]tetrahydropyran-2-yl]methyl ester Formula: C33H55N3O5S MolecularWeight: 605.8719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)SC1CCCOC1COC(=O)NCC2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)SC1CCCOC1COC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C33H55N3O5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-36(28(2)37)33(39)42-31-22-20-25-40-30(31)27-41-32(38)35-26-29-21-17-18-23-34-29/h17-18,21,23,30-31H,3-16,19-20,22,24-27H2,1-2H3,(H,35,38)