2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Openeye Name: 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole CAS Name: 2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole Traditional Name: 2-[4-(3-nitrophenyl)sulfonylpiperazino]-1,3-benzothiazole Formula: C17H16N4O4S2 MolecularWeight: 404.46334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4S2/c22-21(23)13-4-3-5-14(12-13)27(24,25)20-10-8-19(9-11-20)17-18-15-6-1-2-7-16(15)26-17/h1-7,12H,8-11H2