3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(1-pyrazolylmethyl)phenyl]propanamide IUPAC Name: 3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(pyrazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]-N-[3-(pyrazol-1-ylmethyl)phenyl]propionamide Formula: C21H23N5O4S MolecularWeight: 441.50342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CC=CC(=C2)CN3C=CC=N3

InChI

InChI=1S/C21H23N5O4S/c1-16(27)24-18-6-8-20(9-7-18)31(29,30)23-12-10-21(28)25-19-5-2-4-17(14-19)15-26-13-3-11-22-26/h2-9,11,13-14,23H,10,12,15H2,1H3,(H,24,27)(H,25,28)