tert-butyl N-[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[1-benzyl-3-(2-furylmethylsulfanyl)-2-oxo-propyl]-N-methyl-carbamate CAS Name: N-[4-(2-furanylmethylthio)-3-oxo-1-phenylbutan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(furan-2-ylmethylsulfanyl)-3-oxo-1-phenylbutan-2-yl]-N-methylcarbamate Traditional Name: N-[1-benzyl-3-(2-furfurylthio)-2-keto-propyl]-N-methyl-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)N(C)C(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2

InChI

InChI=1S/C21H27NO4S/c1-21(2,3)26-20(24)22(4)18(13-16-9-6-5-7-10-16)19(23)15-27-14-17-11-8-12-25-17/h5-12,18H,13-15H2,1-4H3