(4-naphthalen-1-ylpiperazin-1-yl)-[5-(3-nitrophenyl)furan-2-yl]methanethione

Systemtic Name: (4-naphthalen-1-ylpiperazin-1-yl)-[5-(3-nitrophenyl)furan-2-yl]methanethione Openeye Name: [4-(1-naphthyl)piperazin-1-yl]-[5-(3-nitrophenyl)-2-furyl]methanethione CAS Name: [4-(1-naphthalenyl)-1-piperazinyl]-[5-(3-nitrophenyl)-2-furanyl]methanethione IUPAC Name: (4-naphthalen-1-ylpiperazin-1-yl)-[5-(3-nitrophenyl)furan-2-yl]methanethione Traditional Name: [4-(1-naphthyl)piperazino]-[5-(3-nitrophenyl)-2-furyl]methanethione Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=S)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=S)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O3S/c29-28(30)20-8-3-7-19(17-20)23-11-12-24(31-23)25(32)27-15-13-26(14-16-27)22-10-4-6-18-5-1-2-9-21(18)22/h1-12,17H,13-16H2