(4-naphthalen-1-ylpiperazin-1-yl)-(3-nitrophenyl)methanethione

Systemtic Name: (4-naphthalen-1-ylpiperazin-1-yl)-(3-nitrophenyl)methanethione Openeye Name: [4-(1-naphthyl)piperazin-1-yl]-(3-nitrophenyl)methanethione CAS Name: [4-(1-naphthalenyl)-1-piperazinyl]-(3-nitrophenyl)methanethione IUPAC Name: (4-naphthalen-1-ylpiperazin-1-yl)-(3-nitrophenyl)methanethione Traditional Name: [4-(1-naphthyl)piperazino]-(3-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)18-8-3-7-17(15-18)21(27)23-13-11-22(12-14-23)20-10-4-6-16-5-1-2-9-19(16)20/h1-10,15H,11-14H2