N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-5-nitro-2-phenylsulfanyl-benzamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-5-nitro-2-phenylsulfanyl-benzamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-5-nitro-2-phenylsulfanyl-benzamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-5-nitro-2-(phenylthio)benzamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-5-nitro-2-phenylsulfanylbenzamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-5-nitro-2-(phenylthio)benzamide Formula: C24H23ClN4O3S MolecularWeight: 482.98242

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=CC=C4

InChI

InChI=1S/C24H23ClN4O3S/c1-27-11-13-28(14-12-27)22-9-7-17(25)15-21(22)26-24(30)20-16-18(29(31)32)8-10-23(20)33-19-5-3-2-4-6-19/h2-10,15-16H,11-14H2,1H3,(H,26,30)