N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-2-methyl-propanamide

Systemtic Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-2-methyl-propanamide Openeye Name: N-[(1R)-2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-2-methyl-propanamide CAS Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]-2-methylpropanamide IUPAC Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]-2-methylpropanamide Traditional Name: N-[(1R)-2-keto-1-methyl-2-(4-piazthiol-4-ylsulfonylpiperazino)ethyl]-2-methyl-propionamide Formula: C17H23N5O4S2 MolecularWeight: 425.52562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32)NC(=O)C(C)C

InChI

InChI=1S/C17H23N5O4S2/c1-11(2)16(23)18-12(3)17(24)21-7-9-22(10-8-21)28(25,26)14-6-4-5-13-15(14)20-27-19-13/h4-6,11-12H,7-10H2,1-3H3,(H,18,23)/t12-/m1/s1