6-nitro-2-(4-phenylpiperazin-1-yl)-1,3-benzothiazole

Systemtic Name: 6-nitro-2-(4-phenylpiperazin-1-yl)-1,3-benzothiazole Openeye Name: 6-nitro-2-(4-phenylpiperazin-1-yl)-1,3-benzothiazole CAS Name: 6-nitro-2-(4-phenyl-1-piperazinyl)-1,3-benzothiazole IUPAC Name: 6-nitro-2-(4-phenylpiperazin-1-yl)-1,3-benzothiazole Traditional Name: 6-nitro-2-(4-phenylpiperazino)-1,3-benzothiazole Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O2S/c22-21(23)14-6-7-15-16(12-14)24-17(18-15)20-10-8-19(9-11-20)13-4-2-1-3-5-13/h1-7,12H,8-11H2