N-[(2S)-3-methylbutan-2-yl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-[4-(2-nitrophenyl)sulfonylpiperazino]acetamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c1-13(2)14(3)18-17(22)12-19-8-10-20(11-9-19)27(25,26)16-7-5-4-6-15(16)21(23)24/h4-7,13-14H,8-12H2,1-3H3,(H,18,22)/t14-/m0/s1