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

Systemtic Name: tert-butyl N-[1-cyclohexyl-4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(cyclohexylmethyl)-3-(2-furylmethylsulfanyl)-2-oxo-propyl]carbamate CAS Name: N-[1-cyclohexyl-4-(2-furanylmethylthio)-3-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-cyclohexyl-4-(furan-2-ylmethylsulfanyl)-3-oxobutan-2-yl]carbamate Traditional Name: N-[1-(cyclohexylmethyl)-3-(2-furfurylthio)-2-keto-propyl]carbamic acid tert-butyl ester Formula: C20H31NO4S MolecularWeight: 381.52944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)CSCC2=CC=CO2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)CSCC2=CC=CO2

InChI

InChI=1S/C20H31NO4S/c1-20(2,3)25-19(23)21-17(12-15-8-5-4-6-9-15)18(22)14-26-13-16-10-7-11-24-16/h7,10-11,15,17H,4-6,8-9,12-14H2,1-3H3,(H,21,23)