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

Systemtic Name: 3-[[3-methoxy-2-(naphthalen-1-ylcarbamoylamino)-3-oxidanylidene-propyl]sulfanylmethyl]-4-oxidanylidene-4-pyridin-3-yl-butanoic acid Openeye Name: 3-[[3-methoxy-2-(1-naphthylcarbamoylamino)-3-oxo-propyl]sulfanylmethyl]-4-oxo-4-(3-pyridyl)butanoic acid CAS Name: 3-[[[3-methoxy-2-[[(1-naphthalenylamino)-oxomethyl]amino]-3-oxopropyl]thio]methyl]-4-oxo-4-(3-pyridinyl)butanoic acid IUPAC Name: 3-[[3-methoxy-2-(naphthalen-1-ylcarbamoylamino)-3-oxopropyl]sulfanylmethyl]-4-oxo-4-pyridin-3-ylbutanoic acid Traditional Name: 4-keto-3-[[[3-keto-3-methoxy-2-(1-naphthylcarbamoylamino)propyl]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(CSCC(CC(=O)O)C(=O)C1=CN=CC=C1)NC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)C(CSCC(CC(=O)O)C(=O)C1=CN=CC=C1)NC(=O)NC2=CC=CC3=CC=CC=C32

InChI

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