1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone

Systemtic Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone Openeye Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone CAS Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-2-(2-methyl-1-indolyl)ethanone IUPAC Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone Traditional Name: 2-(2-methylindol-1-yl)-1-(4-piazthiol-4-ylsulfonylpiperazino)ethanone Formula: C21H21N5O3S2 MolecularWeight: 455.55314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H21N5O3S2/c1-15-13-16-5-2-3-7-18(16)26(15)14-20(27)24-9-11-25(12-10-24)31(28,29)19-8-4-6-17-21(19)23-30-22-17/h2-8,13H,9-12,14H2,1H3