tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-5-phenyl-pentyl]carbamate

Systemtic Name: tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxidanylidene-5-phenyl-pentyl]carbamate Openeye Name: tert-butyl N-[1-(2-furylmethylsulfanyl)-2-oxo-5-phenyl-pentyl]carbamate CAS Name: N-[1-(2-furanylmethylthio)-2-oxo-5-phenylpentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(furan-2-ylmethylsulfanyl)-2-oxo-5-phenylpentyl]carbamate Traditional Name: N-[1-(2-furfurylthio)-2-keto-5-phenyl-pentyl]carbamic acid tert-butyl ester Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)CCCC1=CC=CC=C1)SCC2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(=O)CCCC1=CC=CC=C1)SCC2=CC=CO2

InChI

InChI=1S/C21H27NO4S/c1-21(2,3)26-20(24)22-19(27-15-17-12-8-14-25-17)18(23)13-7-11-16-9-5-4-6-10-16/h4-6,8-10,12,14,19H,7,11,13,15H2,1-3H3,(H,22,24)