propan-2-yl 2-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]benzimidazol-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-2-benzimidazolyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-[2-keto-2-(p-anisylamino)ethyl]benzimidazol-2-yl]thio]acetic acid isopropyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NC2=CC=CC=C2N1CC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)OC(=O)CSC1=NC2=CC=CC=C2N1CC(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O4S/c1-15(2)29-21(27)14-30-22-24-18-6-4-5-7-19(18)25(22)13-20(26)23-12-16-8-10-17(28-3)11-9-16/h4-11,15H,12-14H2,1-3H3,(H,23,26)