ethyl 1-ethyl-3-[[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]methyl]-2-sulfanylidene-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-3-[[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]methyl]-2-sulfanylidene-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]-2-thioxo-benzimidazole-5-carboxylate CAS Name: 1-ethyl-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]-2-sulfanylidene-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]-2-sulfanylidenebenzimidazole-5-carboxylate Traditional Name: 1-ethyl-3-[[[2-keto-2-(propylamino)ethyl]-methyl-amino]methyl]-2-thioxo-benzimidazole-5-carboxylic acid ethyl ester Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C2=C(C=CC(=C2)C(=O)OCC)N(C1=S)CC

Isomeric SMILES

CCCNC(=O)CN(C)CN1C2=C(C=CC(=C2)C(=O)OCC)N(C1=S)CC

InChI

InChI=1S/C19H28N4O3S/c1-5-10-20-17(24)12-21(4)13-23-16-11-14(18(25)26-7-3)8-9-15(16)22(6-2)19(23)27/h8-9,11H,5-7,10,12-13H2,1-4H3,(H,20,24)