(6-chloranylimidazo[1,2-a]pyridin-2-yl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (6-chloranylimidazo[1,2-a]pyridin-2-yl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (6-chloro-2-imidazo[1,2-a]pyridinyl)methyl ester IUPAC Name: (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl ester Formula: C21H21ClN4O5S MolecularWeight: 476.93324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CN4C=C(C=CC4=N3)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CN4C=C(C=CC4=N3)Cl

InChI

InChI=1S/C21H21ClN4O5S/c1-15(27)24-7-9-26(10-8-24)32(29,30)19-4-2-3-16(11-19)21(28)31-14-18-13-25-12-17(22)5-6-20(25)23-18/h2-6,11-13H,7-10,14H2,1H3