4-nitro-N-[2-[3-[(4-nitrophenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide

Systemtic Name: 4-nitro-N-[2-[3-[(4-nitrophenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide Openeye Name: 4-nitro-N-[2-[3-[(4-nitrophenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide CAS Name: 4-nitro-N-[2-[3-[(4-nitrophenyl)methylthio]-1-indolyl]ethyl]benzamide IUPAC Name: 4-nitro-N-[2-[3-[(4-nitrophenyl)methylsulfanyl]indol-1-yl]ethyl]benzamide Traditional Name: 4-nitro-N-[2-[3-[(4-nitrobenzyl)thio]indol-1-yl]ethyl]benzamide Formula: C24H20N4O5S MolecularWeight: 476.5044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5S/c29-24(18-7-11-20(12-8-18)28(32)33)25-13-14-26-15-23(21-3-1-2-4-22(21)26)34-16-17-5-9-19(10-6-17)27(30)31/h1-12,15H,13-14,16H2,(H,25,29)