3-[[1-methoxy-3-(naphthalen-1-ylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-4-oxidanylidene-4-pyridin-3-yl-butanoic acid

Systemtic Name: 3-[[1-methoxy-3-(naphthalen-1-ylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-4-oxidanylidene-4-pyridin-3-yl-butanoic acid Openeye Name: 3-[[2-methoxy-1-[(1-naphthylcarbamoylamino)methyl]-2-oxo-ethyl]sulfanylmethyl]-4-oxo-4-(3-pyridyl)butanoic acid CAS Name: 3-[[[1-methoxy-3-[[(1-naphthalenylamino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]methyl]-4-oxo-4-(3-pyridinyl)butanoic acid IUPAC Name: 3-[[1-methoxy-3-(naphthalen-1-ylcarbamoylamino)-1-oxopropan-2-yl]sulfanylmethyl]-4-oxo-4-pyridin-3-ylbutanoic acid Traditional Name: 4-keto-3-[[[2-keto-2-methoxy-1-[(1-naphthylcarbamoylamino)methyl]ethyl]thio]methyl]-4-(3-pyridyl)butyric acid Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)NC1=CC=CC2=CC=CC=C21)SCC(CC(=O)O)C(=O)C3=CN=CC=C3

Isomeric SMILES

COC(=O)C(CNC(=O)NC1=CC=CC2=CC=CC=C21)SCC(CC(=O)O)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C25H25N3O6S/c1-34-24(32)21(35-15-18(12-22(29)30)23(31)17-8-5-11-26-13-17)14-27-25(33)28-20-10-4-7-16-6-2-3-9-19(16)20/h2-11,13,18,21H,12,14-15H2,1H3,(H,29,30)(H2,27,28,33)