2-(dimethylamino)-1-[4-(2-methylphenyl)sulfonylphenyl]-2-(phenylmethyl)butan-1-one

Systemtic Name: 2-(dimethylamino)-1-[4-(2-methylphenyl)sulfonylphenyl]-2-(phenylmethyl)butan-1-one Openeye Name: 2-benzyl-2-(dimethylamino)-1-[4-(o-tolylsulfonyl)phenyl]butan-1-one CAS Name: 2-(dimethylamino)-1-[4-(2-methylphenyl)sulfonylphenyl]-2-(phenylmethyl)-1-butanone IUPAC Name: 2-benzyl-2-(dimethylamino)-1-[4-(2-methylphenyl)sulfonylphenyl]butan-1-one Traditional Name: 2-benzyl-2-(dimethylamino)-1-[4-(o-tolylsulfonyl)phenyl]butan-1-one Formula: C26H29NO3S MolecularWeight: 435.57836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)(C(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C)N(C)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)(C(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C)N(C)C

InChI

InChI=1S/C26H29NO3S/c1-5-26(27(3)4,19-21-12-7-6-8-13-21)25(28)22-15-17-23(18-16-22)31(29,30)24-14-10-9-11-20(24)2/h6-18H,5,19H2,1-4H3