3-[(4-ethanoylphenyl)sulfonylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-[(4-ethanoylphenyl)sulfonylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-[(4-acetylphenyl)sulfonylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-[(4-acetylphenyl)sulfonylamino]-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-[(4-acetylphenyl)sulfonylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4S/c1-16(26)18-7-9-20(10-8-18)30(28,29)24-12-11-21(27)22-13-17-14-23-25(15-17)19-5-3-2-4-6-19/h2-10,14-15,24H,11-13H2,1H3,(H,22,27)