(4-naphthalen-1-ylpiperazin-1-yl)-(2-nitrophenyl)methanethione

Systemtic Name: (4-naphthalen-1-ylpiperazin-1-yl)-(2-nitrophenyl)methanethione Openeye Name: [4-(1-naphthyl)piperazin-1-yl]-(2-nitrophenyl)methanethione CAS Name: [4-(1-naphthalenyl)-1-piperazinyl]-(2-nitrophenyl)methanethione IUPAC Name: (4-naphthalen-1-ylpiperazin-1-yl)-(2-nitrophenyl)methanethione Traditional Name: [4-(1-naphthyl)piperazino]-(2-nitrophenyl)methanethione Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=S)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=S)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O2S/c25-24(26)20-10-4-3-9-18(20)21(27)23-14-12-22(13-15-23)19-11-5-7-16-6-1-2-8-17(16)19/h1-11H,12-15H2