[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-[(methylthio)methyl]-1-benzimidazolyl]acetic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CN3C4=CC=CC=C4N=C3CSC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CN3C4=CC=CC=C4N=C3CSC

InChI

InChI=1S/C22H21N3O3S/c1-14-22(15-7-3-4-8-16(15)23-14)19(26)12-28-21(27)11-25-18-10-6-5-9-17(18)24-20(25)13-29-2/h3-10,23H,11-13H2,1-2H3