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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

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