1-[3-(furan-2-ylmethylsulfanyl)-4-nitro-phenyl]-4-naphthalen-2-ylsulfonyl-piperazine

Systemtic Name: 1-[3-(furan-2-ylmethylsulfanyl)-4-nitro-phenyl]-4-naphthalen-2-ylsulfonyl-piperazine Openeye Name: 1-[3-(2-furylmethylsulfanyl)-4-nitro-phenyl]-4-(2-naphthylsulfonyl)piperazine CAS Name: 1-[3-(2-furanylmethylthio)-4-nitrophenyl]-4-(2-naphthalenylsulfonyl)piperazine IUPAC Name: 1-[3-(furan-2-ylmethylsulfanyl)-4-nitrophenyl]-4-naphthalen-2-ylsulfonylpiperazine Traditional Name: 1-[3-(2-furfurylthio)-4-nitro-phenyl]-4-(2-naphthylsulfonyl)piperazine Formula: C25H23N3O5S2 MolecularWeight: 509.59722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])SCC3=CC=CO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])SCC3=CC=CO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H23N3O5S2/c29-28(30)24-10-8-21(17-25(24)34-18-22-6-3-15-33-22)26-11-13-27(14-12-26)35(31,32)23-9-7-19-4-1-2-5-20(19)16-23/h1-10,15-17H,11-14,18H2