4-(2-methylbutan-2-yl)-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]benzenesulfonamide

Systemtic Name: 4-(2-methylbutan-2-yl)-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]benzenesulfonamide Openeye Name: 4-(1,1-dimethylpropyl)-N-[(1-pyrimidin-2-yl-3-piperidyl)methyl]benzenesulfonamide CAS Name: 4-(2-methylbutan-2-yl)-N-[[1-(2-pyrimidinyl)-3-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-(2-methylbutan-2-yl)-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]benzenesulfonamide Traditional Name: 4-tert-amyl-N-[[1-(2-pyrimidyl)-3-piperidyl]methyl]benzenesulfonamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C3=NC=CC=N3

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C3=NC=CC=N3

InChI

InChI=1S/C21H30N4O2S/c1-4-21(2,3)18-8-10-19(11-9-18)28(26,27)24-15-17-7-5-14-25(16-17)20-22-12-6-13-23-20/h6,8-13,17,24H,4-5,7,14-16H2,1-3H3