N-[(2S)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[(2S)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]cyclopropanecarboxamide Openeye Name: N-[(1S)-2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]cyclopropanecarboxamide CAS Name: N-[(2S)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]cyclopropanecarboxamide IUPAC Name: N-[(2S)-1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-1-oxopropan-2-yl]cyclopropanecarboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(4-piazthiol-4-ylsulfonylpiperazino)ethyl]cyclopropanecarboxamide Formula: C17H21N5O4S2 MolecularWeight: 423.50974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32)NC(=O)C4CC4

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32)NC(=O)C4CC4

InChI

InChI=1S/C17H21N5O4S2/c1-11(18-16(23)12-5-6-12)17(24)21-7-9-22(10-8-21)28(25,26)14-4-2-3-13-15(14)20-27-19-13/h2-4,11-12H,5-10H2,1H3,(H,18,23)/t11-/m0/s1