(phenylmethyl) N-[[1-(furan-3-ylmethylsulfanyl)-2-oxidanylidene-propyl]-(4-methylpentanoyl)amino]carbamate

Systemtic Name: (phenylmethyl) N-[[1-(furan-3-ylmethylsulfanyl)-2-oxidanylidene-propyl]-(4-methylpentanoyl)amino]carbamate Openeye Name: benzyl N-[[1-(3-furylmethylsulfanyl)-2-oxo-propyl]-(4-methylpentanoyl)amino]carbamate CAS Name: N-[[1-(3-furanylmethylthio)-2-oxopropyl]-(4-methyl-1-oxopentyl)amino]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[1-(furan-3-ylmethylsulfanyl)-2-oxopropyl]-(4-methylpentanoyl)amino]carbamate Traditional Name: N-[[1-(3-furfurylthio)-2-keto-propyl]-(4-methylpentanoyl)amino]carbamic acid benzyl ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(C(=O)C)SCC1=COC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCC(=O)N(C(C(=O)C)SCC1=COC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O5S/c1-16(2)9-10-20(26)24(21(17(3)25)30-15-19-11-12-28-13-19)23-22(27)29-14-18-7-5-4-6-8-18/h4-8,11-13,16,21H,9-10,14-15H2,1-3H3,(H,23,27)