tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-hexan-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-hexan-3-yl]carbamate Openeye Name: tert-butyl N-[1-[2-(2-furylmethylsulfanyl)acetyl]butyl]carbamate CAS Name: N-[1-(2-furanylmethylthio)-2-oxohexan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxohexan-3-yl]carbamate Traditional Name: N-[1-[2-(2-furfurylthio)acetyl]butyl]carbamic acid tert-butyl ester Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)CSCC1=CC=CO1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)CSCC1=CC=CO1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H25NO4S/c1-5-7-13(17-15(19)21-16(2,3)4)14(18)11-22-10-12-8-6-9-20-12/h6,8-9,13H,5,7,10-11H2,1-4H3,(H,17,19)