N,N-dimethyl-4-[[3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoylamino]methyl]benzamide

Systemtic Name: N,N-dimethyl-4-[[3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoylamino]methyl]benzamide Openeye Name: N,N-dimethyl-4-[[3-[4-methyl-N-(p-tolylsulfonyl)anilino]propanoylamino]methyl]benzamide CAS Name: N,N-dimethyl-4-[[[3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxopropyl]amino]methyl]benzamide IUPAC Name: N,N-dimethyl-4-[[3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoylamino]methyl]benzamide Traditional Name: N,N-dimethyl-4-[[3-(4-methyl-N-tosyl-anilino)propanoylamino]methyl]benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H31N3O4S/c1-20-5-13-24(14-6-20)30(35(33,34)25-15-7-21(2)8-16-25)18-17-26(31)28-19-22-9-11-23(12-10-22)27(32)29(3)4/h5-16H,17-19H2,1-4H3,(H,28,31)