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

Systemtic Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]ethylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]ethylsulfanyl]-1,3-benzothiazole CAS Name: 2-[2-[4-(2-nitrophenyl)-1-piperazinyl]ethylthio]-1,3-benzothiazole IUPAC Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]ethylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[2-[4-(2-nitrophenyl)piperazino]ethylthio]-1,3-benzothiazole Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=NC3=CC=CC=C3S2)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCSC2=NC3=CC=CC=C3S2)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O2S2/c24-23(25)17-7-3-2-6-16(17)22-11-9-21(10-12-22)13-14-26-19-20-15-5-1-4-8-18(15)27-19/h1-8H,9-14H2