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

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-[(4-piperidin-1-ylphenyl)methyl]benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-[[4-(1-piperidyl)phenyl]methyl]benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[[4-(1-piperidinyl)phenyl]methyl]benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-[(4-piperidin-1-ylphenyl)methyl]benzamide Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]-N-(4-piperidinobenzyl)benzamide Formula: C29H35N3O3S MolecularWeight: 505.6715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCCC4)S(=O)(=O)C)C

InChI

InChI=1S/C29H35N3O3S/c1-22-7-14-28(19-23(22)2)32(36(3,34)35)21-25-8-12-26(13-9-25)29(33)30-20-24-10-15-27(16-11-24)31-17-5-4-6-18-31/h7-16,19H,4-6,17-18,20-21H2,1-3H3,(H,30,33)