1-benzofuran-2-yl-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: 2-benzofuranyl-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C20H16N4O4S/c25-19(17-11-13-3-1-2-4-16(13)28-17)22-7-9-23(10-8-22)20-21-15-6-5-14(24(26)27)12-18(15)29-20/h1-6,11-12H,7-10H2