2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(4-methylphenyl)-phenyl-methyl]propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[(4-methylphenyl)-phenyl-methyl]propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-[phenyl(p-tolyl)methyl]propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[(4-methylphenyl)-phenylmethyl]propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[(4-methylphenyl)-phenylmethyl]propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-[phenyl(p-tolyl)methyl]propionamide Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O3S/c1-18-11-13-23(14-12-18)25(22-9-7-6-8-10-22)27-26(29)21(4)28(32(5,30)31)24-16-19(2)15-20(3)17-24/h6-17,21,25H,1-5H3,(H,27,29)