1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-naphthalen-2-ylsulfonyl-piperazine

Systemtic Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-naphthalen-2-ylsulfonyl-piperazine Openeye Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(2-naphthylsulfonyl)piperazine CAS Name: 1-[3-(3,5-dimethyl-1-pyrazolyl)-4-nitrophenyl]-4-(2-naphthalenylsulfonyl)piperazine IUPAC Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine Traditional Name: 1-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-4-(2-naphthylsulfonyl)piperazine Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H25N5O4S/c1-18-15-19(2)29(26-18)25-17-22(8-10-24(25)30(31)32)27-11-13-28(14-12-27)35(33,34)23-9-7-20-5-3-4-6-21(20)16-23/h3-10,15-17H,11-14H2,1-2H3