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

Systemtic Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-2-methoxy-ethanamide Openeye Name: N-[(1R)-2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-2-methoxy-acetamide CAS Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]-2-methoxyacetamide IUPAC Name: N-[(2R)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]-2-methoxyacetamide Traditional Name: N-[(1R)-2-keto-1-methyl-2-(4-piazthiol-4-ylsulfonylpiperazino)ethyl]-2-methoxy-acetamide Formula: C16H21N5O5S2 MolecularWeight: 427.49844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O5S2/c1-11(17-14(22)10-26-2)16(23)20-6-8-21(9-7-20)28(24,25)13-5-3-4-12-15(13)19-27-18-12/h3-5,11H,6-10H2,1-2H3,(H,17,22)/t11-/m1/s1