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

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-[(3-methyl-N-methylsulfonyl-anilino)methyl]benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-[(3-methyl-N-methylsulfonylanilino)methyl]benzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-[(3-methyl-N-methylsulfonylanilino)methyl]benzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-4-[(N-mesyl-3-methyl-anilino)methyl]benzamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O3S/c1-18-5-3-6-21(15-18)26(30(2,28)29)16-19-7-9-20(10-8-19)22(27)24-11-4-13-25-14-12-23-17-25/h3,5-10,12,14-15,17H,4,11,13,16H2,1-2H3,(H,24,27)