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

Systemtic Name: (4-naphthalen-1-ylpiperazin-1-yl)-[5-(2-nitrophenyl)furan-2-yl]methanethione Openeye Name: [4-(1-naphthyl)piperazin-1-yl]-[5-(2-nitrophenyl)-2-furyl]methanethione CAS Name: [4-(1-naphthalenyl)-1-piperazinyl]-[5-(2-nitrophenyl)-2-furanyl]methanethione IUPAC Name: (4-naphthalen-1-ylpiperazin-1-yl)-[5-(2-nitrophenyl)furan-2-yl]methanethione Traditional Name: [4-(1-naphthyl)piperazino]-[5-(2-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)22-10-4-3-9-20(22)23-12-13-24(31-23)25(32)27-16-14-26(15-17-27)21-11-5-7-18-6-1-2-8-19(18)21/h1-13H,14-17H2