2-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2-nitro-4-pyrrolidinosulfonyl-phenyl)piperazino]acetamide Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O5S/c29-23(24-17-19-6-2-1-3-7-19)18-25-12-14-26(15-13-25)21-9-8-20(16-22(21)28(30)31)34(32,33)27-10-4-5-11-27/h1-3,6-9,16H,4-5,10-15,17-18H2,(H,24,29)