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

Systemtic Name: ethyl 1-ethyl-2-[1-[(3-fluorophenyl)methyl-methyl-amino]-1-oxidanylidene-propan-2-yl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-[2-[(3-fluorophenyl)methyl-methyl-amino]-1-methyl-2-oxo-ethyl]sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[1-[(3-fluorophenyl)methyl-methylamino]-1-oxopropan-2-yl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[1-[(3-fluorophenyl)methyl-methylamino]-1-oxopropan-2-yl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-[[2-[(3-fluorobenzyl)-methyl-amino]-2-keto-1-methyl-ethyl]thio]benzimidazole-5-carboxylic acid ethyl ester Formula: C23H26FN3O3S MolecularWeight: 443.534243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(C)C(=O)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(C)C(=O)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H26FN3O3S/c1-5-27-20-11-10-17(22(29)30-6-2)13-19(20)25-23(27)31-15(3)21(28)26(4)14-16-8-7-9-18(24)12-16/h7-13,15H,5-6,14H2,1-4H3