ethyl 1-ethyl-2-[2-[(1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-[(1-methoxy-3-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[(1-methoxycarbonyl-2-methyl-butyl)amino]-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-[(1-methoxy-3-methyl-1-oxopentan-2-yl)amino]-2-oxoethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-[(1-methoxy-3-methyl-1-oxopentan-2-yl)amino]-2-oxoethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 2-[[2-[(1-carbomethoxy-2-methyl-butyl)amino]-2-keto-ethyl]thio]-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C21H29N3O5S MolecularWeight: 435.53706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)C(=O)OCC

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC2=C(N1CC)C=CC(=C2)C(=O)OCC

InChI

InChI=1S/C21H29N3O5S/c1-6-13(4)18(20(27)28-5)23-17(25)12-30-21-22-15-11-14(19(26)29-8-3)9-10-16(15)24(21)7-2/h9-11,13,18H,6-8,12H2,1-5H3,(H,23,25)