pyridin-3-ylmethyl N-[1-[[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[1-[[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: 3-pyridylmethyl N-[1-[[1-benzyl-3-(2-furylmethylsulfanyl)-2-oxo-propyl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[4-(2-furanylmethylthio)-3-oxo-1-phenylbutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[1-[[4-(furan-2-ylmethylsulfanyl)-3-oxo-1-phenylbutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[[1-benzyl-3-(2-furfurylthio)-2-keto-propyl]carbamoyl]-3-methyl-butyl]carbamic acid 3-pyridylmethyl ester Formula: C28H33N3O5S MolecularWeight: 523.64372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2)NC(=O)OCC3=CN=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2)NC(=O)OCC3=CN=CC=C3

InChI

InChI=1S/C28H33N3O5S/c1-20(2)14-25(31-28(34)36-17-22-10-6-12-29-16-22)27(33)30-24(15-21-8-4-3-5-9-21)26(32)19-37-18-23-11-7-13-35-23/h3-13,16,20,24-25H,14-15,17-19H2,1-2H3,(H,30,33)(H,31,34)