4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(3-imidazol-1-ylpropyl)benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-4-[(N-mesyl-3,4-dimethyl-anilino)methyl]benzamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3)S(=O)(=O)C)C

InChI

InChI=1S/C23H28N4O3S/c1-18-5-10-22(15-19(18)2)27(31(3,29)30)16-20-6-8-21(9-7-20)23(28)25-11-4-13-26-14-12-24-17-26/h5-10,12,14-15,17H,4,11,13,16H2,1-3H3,(H,25,28)