N,N-bis[(2R)-butan-2-yl]-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanamide

Systemtic Name: N,N-bis[(2R)-butan-2-yl]-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanamide Openeye Name: 2-[3,5-dimethyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrazol-1-yl]-N,N-bis[(1R)-1-methylpropyl]acetamide CAS Name: N,N-bis[(2R)-butan-2-yl]-2-[3,5-dimethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]acetamide IUPAC Name: N,N-bis[(2R)-butan-2-yl]-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonylpyrazol-1-yl]acetamide Traditional Name: 2-[3,5-dimethyl-4-(4-methylpiperidino)sulfonyl-pyrazol-1-yl]-N,N-bis[(1R)-1-methylpropyl]acetamide Formula: C21H38N4O3S MolecularWeight: 426.61642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=O)CN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C)C

Isomeric SMILES

CC[C@@H](C)N([C@H](C)CC)C(=O)CN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C)C

InChI

InChI=1S/C21H38N4O3S/c1-8-16(4)25(17(5)9-2)20(26)14-24-19(7)21(18(6)22-24)29(27,28)23-12-10-15(3)11-13-23/h15-17H,8-14H2,1-7H3/t16-,17-/m1/s1