2-[1-[4-(4-iodanyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,3-benzothiazole

Systemtic Name: 2-[1-[4-(4-iodanyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,3-benzothiazole Openeye Name: 2-[1-[4-(4-iodo-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,3-benzothiazole CAS Name: 2-[1-[4-(4-iodo-2-nitrophenyl)-1-piperazinyl]ethyl]-1,3-benzothiazole IUPAC Name: 2-[1-[4-(4-iodo-2-nitrophenyl)piperazin-1-yl]ethyl]-1,3-benzothiazole Traditional Name: 2-[1-[4-(4-iodo-2-nitro-phenyl)piperazino]ethyl]-1,3-benzothiazole Formula: C19H19IN4O2S MolecularWeight: 494.34923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C4=C(C=C(C=C4)I)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C4=C(C=C(C=C4)I)[N+](=O)[O-]

InChI

InChI=1S/C19H19IN4O2S/c1-13(19-21-15-4-2-3-5-18(15)27-19)22-8-10-23(11-9-22)16-7-6-14(20)12-17(16)24(25)26/h2-7,12-13H,8-11H2,1H3