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

Systemtic Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]thio]ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]sulfanyl]ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[[2-(4-methoxyphenyl)-1H-indol-3-yl]thio]ethyl]-2-methyl-3-nitro-benzamide Formula: C25H23N3O4S MolecularWeight: 461.53282

Click to see the large picture

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)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O4S/c1-16-19(7-5-9-22(16)28(30)31)25(29)26-14-15-33-24-20-6-3-4-8-21(20)27-23(24)17-10-12-18(32-2)13-11-17/h3-13,27H,14-15H2,1-2H3,(H,26,29)