N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]ethanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[3,5-dimethyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrazol-1-yl]acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[3,5-dimethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]acetamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonylpyrazol-1-yl]acetamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[3,5-dimethyl-4-(4-methylpiperidino)sulfonyl-pyrazol-1-yl]acetamide Formula: C21H29ClN4O3S MolecularWeight: 452.99796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)CC(=O)NC3=C(C=C(C=C3Cl)C)C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)CC(=O)NC3=C(C=C(C=C3Cl)C)C)C

InChI

InChI=1S/C21H29ClN4O3S/c1-13-6-8-25(9-7-13)30(28,29)21-16(4)24-26(17(21)5)12-19(27)23-20-15(3)10-14(2)11-18(20)22/h10-11,13H,6-9,12H2,1-5H3,(H,23,27)