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

Systemtic Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-nitro-benzamide Openeye Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-nitro-benzamide CAS Name: N-[2-[3-[(3,4-dichlorophenyl)methylthio]-1-indolyl]ethyl]-4-nitrobenzamide IUPAC Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-nitrobenzamide Traditional Name: N-[2-[3-[(3,4-dichlorobenzyl)thio]indol-1-yl]ethyl]-4-nitro-benzamide Formula: C24H19Cl2N3O3S MolecularWeight: 500.39696

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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)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H19Cl2N3O3S/c25-20-10-5-16(13-21(20)26)15-33-23-14-28(22-4-2-1-3-19(22)23)12-11-27-24(30)17-6-8-18(9-7-17)29(31)32/h1-10,13-14H,11-12,15H2,(H,27,30)