4-[3,3-bis(1-ethyl-2-methyl-indol-3-yl)-1-(4-methylphenyl)sulfonyl-prop-2-enyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[3,3-bis(1-ethyl-2-methyl-indol-3-yl)-1-(4-methylphenyl)sulfonyl-prop-2-enyl]-N,N-dimethyl-aniline Openeye Name: 4-[3,3-bis(1-ethyl-2-methyl-indol-3-yl)-1-(p-tolylsulfonyl)allyl]-N,N-dimethyl-aniline CAS Name: 4-[3,3-bis(1-ethyl-2-methyl-3-indolyl)-1-(4-methylphenyl)sulfonylprop-2-enyl]-N,N-dimethylaniline IUPAC Name: 4-[3,3-bis(1-ethyl-2-methylindol-3-yl)-1-(4-methylphenyl)sulfonylprop-2-enyl]-N,N-dimethylaniline Traditional Name: [4-[3,3-bis(1-ethyl-2-methyl-indol-3-yl)-1-tosyl-allyl]phenyl]-dimethyl-amine Formula: C40H43N3O2S MolecularWeight: 629.85332

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(=CC(C3=CC=C(C=C3)N(C)C)S(=O)(=O)C4=CC=C(C=C4)C)C5=C(N(C6=CC=CC=C65)CC)C)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(=CC(C3=CC=C(C=C3)N(C)C)S(=O)(=O)C4=CC=C(C=C4)C)C5=C(N(C6=CC=CC=C65)CC)C)C

InChI

InChI=1S/C40H43N3O2S/c1-8-42-28(4)39(33-14-10-12-16-36(33)42)35(40-29(5)43(9-2)37-17-13-11-15-34(37)40)26-38(30-20-22-31(23-21-30)41(6)7)46(44,45)32-24-18-27(3)19-25-32/h10-26,38H,8-9H2,1-7H3