4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-ethylsulfanylphenyl)benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(2-ethylsulfanylphenyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-(2-ethylsulfanylphenyl)benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[2-(ethylthio)phenyl]benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(2-ethylsulfanylphenyl)benzamide Traditional Name: N-[2-(ethylthio)phenyl]-4-[(N-mesyl-3,4-dimethyl-anilino)methyl]benzamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN(C3=CC(=C(C=C3)C)C)S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN(C3=CC(=C(C=C3)C)C)S(=O)(=O)C

InChI

InChI=1S/C25H28N2O3S2/c1-5-31-24-9-7-6-8-23(24)26-25(28)21-13-11-20(12-14-21)17-27(32(4,29)30)22-15-10-18(2)19(3)16-22/h6-16H,5,17H2,1-4H3,(H,26,28)