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

Systemtic Name: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-[(1-phenyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1-phenylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]-2-[(1-phenylbenzimidazol-2-yl)thio]ethanone Formula: C26H22N6O3S2 MolecularWeight: 530.62128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=NC5=CC=CC=C5N4C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=NC5=CC=CC=C5N4C6=CC=CC=C6

InChI

InChI=1S/C26H22N6O3S2/c33-24(17-36-26-27-20-8-4-5-9-22(20)31(26)18-6-2-1-3-7-18)29-12-14-30(15-13-29)25-28-21-11-10-19(32(34)35)16-23(21)37-25/h1-11,16H,12-15,17H2