2-naphthalen-2-ylsulfanyl-1-[4-(2-nitrophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-naphthalen-2-ylsulfanyl-1-[4-(2-nitrophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthylsulfanyl)-1-[4-(2-nitrophenyl)piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenylthio)-1-[4-(2-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-ylsulfanyl-1-[4-(2-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-naphthylthio)-1-[4-(2-nitrophenyl)piperazino]ethanone Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H21N3O3S/c26-22(16-29-19-10-9-17-5-1-2-6-18(17)15-19)24-13-11-23(12-14-24)20-7-3-4-8-21(20)25(27)28/h1-10,15H,11-14,16H2