4-[[3-[(2,4-dimethylphenyl)sulfonylamino]propanoyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[3-[(2,4-dimethylphenyl)sulfonylamino]propanoyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[3-[(2,4-dimethylphenyl)sulfonylamino]propanoyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[3-[(2,4-dimethylphenyl)sulfonylamino]-1-oxopropyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[3-[(2,4-dimethylphenyl)sulfonylamino]propanoyl-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[3-[(2,4-dimethylphenyl)sulfonylamino]propanoyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

InChI

InChI=1S/C21H27N3O4S/c1-15-5-10-19(16(2)13-15)29(27,28)23-12-11-20(25)24(4)14-17-6-8-18(9-7-17)21(26)22-3/h5-10,13,23H,11-12,14H2,1-4H3,(H,22,26)