[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanone

Systemtic Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanone Openeye Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(3-nitrophenyl)-2-furyl]methanone CAS Name: [4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-[5-(3-nitrophenyl)-2-furanyl]methanone IUPAC Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanone Traditional Name: [4-(1,2-benzothiazol-3-yl)piperazino]-[5-(3-nitrophenyl)-2-furyl]methanone Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4S/c27-22(19-9-8-18(30-19)15-4-3-5-16(14-15)26(28)29)25-12-10-24(11-13-25)21-17-6-1-2-7-20(17)31-23-21/h1-9,14H,10-13H2