4-[1-(4-methylphenyl)sulfonyl-3-phenyl-indol-2-yl]butan-2-one

Systemtic Name: 4-[1-(4-methylphenyl)sulfonyl-3-phenyl-indol-2-yl]butan-2-one Openeye Name: 4-[3-phenyl-1-(p-tolylsulfonyl)indol-2-yl]butan-2-one CAS Name: 4-[1-(4-methylphenyl)sulfonyl-3-phenyl-2-indolyl]-2-butanone IUPAC Name: 4-[1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one Traditional Name: 4-(3-phenyl-1-tosyl-indol-2-yl)butan-2-one Formula: C25H23NO3S MolecularWeight: 417.52002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C(=C2CCC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C(=C2CCC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H23NO3S/c1-18-12-15-21(16-13-18)30(28,29)26-23-11-7-6-10-22(23)25(20-8-4-3-5-9-20)24(26)17-14-19(2)27/h3-13,15-16H,14,17H2,1-2H3