N-[3-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenyl]-2-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[3-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenyl]-2-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-[3-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]-2-(p-tolylsulfonylamino)propanamide CAS Name: N-[3-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]-2-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-[3-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-[3-(5-keto-3-methyl-2-pyrazolin-1-yl)phenyl]-2-(tosylamino)propionamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC(=CC=C2)NC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC(=CC=C2)NC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4O4S/c1-13-7-9-18(10-8-13)29(27,28)23-15(3)20(26)21-16-5-4-6-17(12-16)24-19(25)11-14(2)22-24/h4-10,12,15,23H,11H2,1-3H3,(H,21,26)