methyl 3-[1,3-bis(3-methoxy-3-oxidanylidene-propyl)-2-sulfanylidene-indol-3-yl]propanoate

Systemtic Name: methyl 3-[1,3-bis(3-methoxy-3-oxidanylidene-propyl)-2-sulfanylidene-indol-3-yl]propanoate Openeye Name: methyl 3-[1,3-bis(3-methoxy-3-oxo-propyl)-2-thioxo-indolin-3-yl]propanoate CAS Name: 3-[1,3-bis(3-methoxy-3-oxopropyl)-2-sulfanylidene-3-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1,3-bis(3-methoxy-3-oxopropyl)-2-sulfanylideneindol-3-yl]propanoate Traditional Name: 3-[1,3-bis(3-keto-3-methoxy-propyl)-2-thioxo-indolin-3-yl]propionic acid methyl ester Formula: C20H25NO6S MolecularWeight: 407.4806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1(C2=CC=CC=C2N(C1=S)CCC(=O)OC)CCC(=O)OC

Isomeric SMILES

COC(=O)CCC1(C2=CC=CC=C2N(C1=S)CCC(=O)OC)CCC(=O)OC

InChI

InChI=1S/C20H25NO6S/c1-25-16(22)8-11-20(12-9-17(23)26-2)14-6-4-5-7-15(14)21(19(20)28)13-10-18(24)27-3/h4-7H,8-13H2,1-3H3