2-naphthalen-2-yl-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-naphthalen-2-yl-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthyl)-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenyl)-1-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-yl-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(2-naphthyl)-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H20N4O3S/c28-22(14-16-5-6-17-3-1-2-4-18(17)13-16)25-9-11-26(12-10-25)23-24-20-8-7-19(27(29)30)15-21(20)31-23/h1-8,13,15H,9-12,14H2