N,N-bis[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]-1-phenyl-methanamine

Systemtic Name: N,N-bis[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]-1-phenyl-methanamine Openeye Name: 1-phenyl-N,N-bis[[1-(p-tolylsulfonyl)indol-2-yl]methyl]methanamine CAS Name: N,N-bis[[1-(4-methylphenyl)sulfonyl-2-indolyl]methyl]-1-phenylmethanamine IUPAC Name: N,N-bis[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]-1-phenylmethanamine Traditional Name: benzyl-bis[(1-tosylindol-2-yl)methyl]amine Formula: C39H35N3O4S2 MolecularWeight: 673.8429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2CN(CC4=CC=CC=C4)CC5=CC6=CC=CC=C6N5S(=O)(=O)C7=CC=C(C=C7)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2CN(CC4=CC=CC=C4)CC5=CC6=CC=CC=C6N5S(=O)(=O)C7=CC=C(C=C7)C

InChI

InChI=1S/C39H35N3O4S2/c1-29-16-20-36(21-17-29)47(43,44)41-34(24-32-12-6-8-14-38(32)41)27-40(26-31-10-4-3-5-11-31)28-35-25-33-13-7-9-15-39(33)42(35)48(45,46)37-22-18-30(2)19-23-37/h3-25H,26-28H2,1-2H3