N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]thio]ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[[2-(4-chlorophenyl)-1H-indol-3-yl]thio]ethyl]-2-methyl-3-nitro-benzamide Formula: C24H20ClN3O3S MolecularWeight: 465.9519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCSC2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCSC2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H20ClN3O3S/c1-15-18(6-4-8-21(15)28(30)31)24(29)26-13-14-32-23-19-5-2-3-7-20(19)27-22(23)16-9-11-17(25)12-10-16/h2-12,27H,13-14H2,1H3,(H,26,29)