2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(4-nitrophenyl)thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(4-nitrophenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-nitrophenyl)thio]-1-(4-phenylpiperazino)ethanone Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O3S/c22-18(14-25-17-8-6-16(7-9-17)21(23)24)20-12-10-19(11-13-20)15-4-2-1-3-5-15/h1-9H,10-14H2