N-[2-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethanoylamino]ethyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethanoylamino]ethyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[[2-(4-tert-butyl-2,6-dimethyl-phenyl)acetyl]amino]ethyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-[[2-(4-tert-butyl-2,6-dimethylphenyl)-1-oxoethyl]amino]ethyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-[[2-(4-tert-butyl-2,6-dimethylphenyl)acetyl]amino]ethyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[[2-(4-tert-butyl-2,6-dimethyl-phenyl)acetyl]amino]ethyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C29H41N3O4S MolecularWeight: 527.71854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCNC(=O)CC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCNC(=O)CC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C29H41N3O4S/c1-20-10-11-24(37(35,36)32-14-8-7-9-15-32)18-26(20)28(34)31-13-12-30-27(33)19-25-21(2)16-23(17-22(25)3)29(4,5)6/h10-11,16-18H,7-9,12-15,19H2,1-6H3,(H,30,33)(H,31,34)