2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(2-pyrazol-1-ylpyridin-3-yl)ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(2-pyrazol-1-ylpyridin-3-yl)ethanamide Openeye Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(2-pyrazol-1-yl-3-pyridyl)acetamide CAS Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-[2-(1-pyrazolyl)-3-pyridinyl]acetamide IUPAC Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-(2-pyrazol-1-ylpyridin-3-yl)acetamide Traditional Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]-N-(2-pyrazol-1-yl-3-pyridyl)acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(N=CC=C2)N3C=CC=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(N=CC=C2)N3C=CC=N3)C

InChI

InChI=1S/C19H21N5O3S/c1-14-7-8-16(12-15(14)2)28(26,27)23(3)13-18(25)22-17-6-4-9-20-19(17)24-11-5-10-21-24/h4-12H,13H2,1-3H3,(H,22,25)