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

Systemtic Name: 4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-[(3-chloro-N-methylsulfonyl-anilino)methyl]-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-[(3-chloro-N-mesyl-anilino)methyl]-N-(3-imidazol-1-ylpropyl)benzamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCCCN2C=CN=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCCCN2C=CN=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN4O3S/c1-30(28,29)26(20-5-2-4-19(22)14-20)15-17-6-8-18(9-7-17)21(27)24-10-3-12-25-13-11-23-16-25/h2,4-9,11,13-14,16H,3,10,12,15H2,1H3,(H,24,27)