2-methyl-N-[4-methyl-3-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-methyl-3-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]phenyl]propanamide Openeye Name: 2-methyl-N-[4-methyl-3-[[2-[methyl(p-tolylsulfonyl)amino]acetyl]amino]phenyl]propanamide CAS Name: 2-methyl-N-[4-methyl-3-[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-methyl-3-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]phenyl]propanamide Traditional Name: 2-methyl-N-[4-methyl-3-[[2-[methyl(tosyl)amino]acetyl]amino]phenyl]propionamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(C=CC(=C2)NC(=O)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(C=CC(=C2)NC(=O)C(C)C)C

InChI

InChI=1S/C21H27N3O4S/c1-14(2)21(26)22-17-9-8-16(4)19(12-17)23-20(25)13-24(5)29(27,28)18-10-6-15(3)7-11-18/h6-12,14H,13H2,1-5H3,(H,22,26)(H,23,25)