2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-1-[4-(4-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanyl-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]-1-[4-(4-nitrophenyl)piperazino]ethanone Formula: C22H24ClN5O3S MolecularWeight: 473.97566

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24ClN5O3S/c1-2-9-27-20-8-3-16(23)14-19(20)24-22(27)32-15-21(29)26-12-10-25(11-13-26)17-4-6-18(7-5-17)28(30)31/h3-8,14H,2,9-13,15H2,1H3