ethyl 3-[3-(3-ethoxy-3-oxidanylidene-propyl)-2-sulfanylidene-benzimidazol-1-yl]propanoate

Systemtic Name: ethyl 3-[3-(3-ethoxy-3-oxidanylidene-propyl)-2-sulfanylidene-benzimidazol-1-yl]propanoate Openeye Name: ethyl 3-[3-(3-ethoxy-3-oxo-propyl)-2-thioxo-benzimidazol-1-yl]propanoate CAS Name: 3-[3-(3-ethoxy-3-oxopropyl)-2-sulfanylidene-1-benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(3-ethoxy-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanoate Traditional Name: 3-[3-(3-ethoxy-3-keto-propyl)-2-thioxo-benzimidazol-1-yl]propionic acid ethyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=CC=CC=C2N(C1=S)CCC(=O)OCC

Isomeric SMILES

CCOC(=O)CCN1C2=CC=CC=C2N(C1=S)CCC(=O)OCC

InChI

InChI=1S/C17H22N2O4S/c1-3-22-15(20)9-11-18-13-7-5-6-8-14(13)19(17(18)24)12-10-16(21)23-4-2/h5-8H,3-4,9-12H2,1-2H3