N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-2-methylsulfonyl-ethanamine

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-2-methylsulfonyl-ethanamine Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-2-methylsulfonyl-ethanamine CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N-methyl-2-methylsulfonylethanamine IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methyl-2-methylsulfonylethanamine Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-(2-mesylethyl)-methyl-amine Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CCS(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CCS(=O)(=O)C

InChI

InChI=1S/C16H23N3O2S/c1-13-16(12-18(3)10-11-22(4,20)21)14(2)19(17-13)15-8-6-5-7-9-15/h5-9H,10-12H2,1-4H3