methyl 3-[3-(4-methoxy-4-oxidanylidene-butan-2-yl)-2-sulfanylidene-benzimidazol-1-yl]butanoate

Systemtic Name: methyl 3-[3-(4-methoxy-4-oxidanylidene-butan-2-yl)-2-sulfanylidene-benzimidazol-1-yl]butanoate Openeye Name: methyl 3-[3-(3-methoxy-1-methyl-3-oxo-propyl)-2-thioxo-benzimidazol-1-yl]butanoate CAS Name: 3-[3-(4-methoxy-4-oxobutan-2-yl)-2-sulfanylidene-1-benzimidazolyl]butanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-methoxy-4-oxobutan-2-yl)-2-sulfanylidenebenzimidazol-1-yl]butanoate Traditional Name: 3-[3-(3-keto-3-methoxy-1-methyl-propyl)-2-thioxo-benzimidazol-1-yl]butyric acid methyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)N1C2=CC=CC=C2N(C1=S)C(C)CC(=O)OC

Isomeric SMILES

CC(CC(=O)OC)N1C2=CC=CC=C2N(C1=S)C(C)CC(=O)OC

InChI

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