N-[(2S,3S)-3-methyl-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[(2S,3S)-3-methyl-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[(1S,2S)-2-methyl-1-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]butyl]benzamide CAS Name: N-[(2S,3S)-3-methyl-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-1-oxopentan-2-yl]benzamide IUPAC Name: N-[(2S,3S)-3-methyl-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S,2S)-2-methyl-1-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]butyl]benzamide Formula: C23H28N4O6S MolecularWeight: 488.55662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O6S/c1-3-17(2)21(24-22(28)18-8-5-4-6-9-18)23(29)25-12-14-26(15-13-25)34(32,33)20-11-7-10-19(16-20)27(30)31/h4-11,16-17,21H,3,12-15H2,1-2H3,(H,24,28)/t17-,21-/m0/s1