methyl 3-[2-cyano-4-(2-methoxy-2-oxidanylidene-ethyl)-5-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-2-methyl-5-sulfanylidene-1H-pyrrol-2-yl]methyl]-1H-pyrrol-3-yl]propanoate

Systemtic Name: methyl 3-[2-cyano-4-(2-methoxy-2-oxidanylidene-ethyl)-5-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-2-methyl-5-sulfanylidene-1H-pyrrol-2-yl]methyl]-1H-pyrrol-3-yl]propanoate Openeye Name: methyl 3-[2-cyano-4-(2-methoxy-2-oxo-ethyl)-5-[[3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-2-methyl-5-thioxo-1H-pyrrol-2-yl]methyl]-1H-pyrrol-3-yl]propanoate CAS Name: 3-[2-cyano-4-(2-methoxy-2-oxoethyl)-5-[[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-2-methyl-5-sulfanylidene-1H-pyrrol-2-yl]methyl]-1H-pyrrol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-cyano-4-(2-methoxy-2-oxoethyl)-5-[[3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-2-methyl-5-sulfanylidene-1H-pyrrol-2-yl]methyl]-1H-pyrrol-3-yl]propanoate Traditional Name: 3-[2-cyano-4-(2-keto-2-methoxy-ethyl)-5-[[3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-2-methyl-5-thioxo-3-pyrrolin-2-yl]methyl]-1H-pyrrol-3-yl]propionic acid methyl ester Formula: C25H31N3O8S MolecularWeight: 533.59394

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=S)N1)CCC(=O)OC)CC(=O)OC)CC2=C(C(=C(N2)C#N)CCC(=O)OC)CC(=O)OC

Isomeric SMILES

CC1(C(=C(C(=S)N1)CCC(=O)OC)CC(=O)OC)CC2=C(C(=C(N2)C#N)CCC(=O)OC)CC(=O)OC

InChI

InChI=1S/C25H31N3O8S/c1-25(17(11-23(32)36-5)15(24(37)28-25)7-9-21(30)34-3)12-18-16(10-22(31)35-4)14(19(13-26)27-18)6-8-20(29)33-2/h27H,6-12H2,1-5H3,(H,28,37)