ethyl 1-ethyl-2-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-(isobutylcarbamoylamino)-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-(isobutylcarbamoylamino)-2-keto-ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C19H26N4O4S/c1-5-23-15-8-7-13(17(25)27-6-2)9-14(15)21-19(23)28-11-16(24)22-18(26)20-10-12(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H2,20,22,24,26)