4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-[(4-piperidin-1-ylphenyl)methyl]benzamide

Systemtic Name: 4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-[(4-piperidin-1-ylphenyl)methyl]benzamide Openeye Name: 4-[(3-chloro-N-methylsulfonyl-anilino)methyl]-N-[[4-(1-piperidyl)phenyl]methyl]benzamide CAS Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[[4-(1-piperidinyl)phenyl]methyl]benzamide IUPAC Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[(4-piperidin-1-ylphenyl)methyl]benzamide Traditional Name: 4-[(3-chloro-N-mesyl-anilino)methyl]-N-(4-piperidinobenzyl)benzamide Formula: C27H30ClN3O3S MolecularWeight: 512.0634

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)N3CCCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)N3CCCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H30ClN3O3S/c1-35(33,34)31(26-7-5-6-24(28)18-26)20-22-8-12-23(13-9-22)27(32)29-19-21-10-14-25(15-11-21)30-16-3-2-4-17-30/h5-15,18H,2-4,16-17,19-20H2,1H3,(H,29,32)