methyl 3-[3-(3-methoxy-3-oxidanylidene-propyl)-2-sulfanylidene-benzimidazol-1-yl]propanoate

Systemtic Name: methyl 3-[3-(3-methoxy-3-oxidanylidene-propyl)-2-sulfanylidene-benzimidazol-1-yl]propanoate Openeye Name: methyl 3-[3-(3-methoxy-3-oxo-propyl)-2-thioxo-benzimidazol-1-yl]propanoate CAS Name: 3-[3-(3-methoxy-3-oxopropyl)-2-sulfanylidene-1-benzimidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(3-methoxy-3-oxopropyl)-2-sulfanylidenebenzimidazol-1-yl]propanoate Traditional Name: 3-[3-(3-keto-3-methoxy-propyl)-2-thioxo-benzimidazol-1-yl]propionic acid methyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=CC=CC=C2N(C1=S)CCC(=O)OC

Isomeric SMILES

COC(=O)CCN1C2=CC=CC=C2N(C1=S)CCC(=O)OC

InChI

InChI=1S/C15H18N2O4S/c1-20-13(18)7-9-16-11-5-3-4-6-12(11)17(15(16)22)10-8-14(19)21-2/h3-6H,7-10H2,1-2H3