(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenylpyrazol-4-yl)ethyl]propanamide

Systemtic Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenylpyrazol-4-yl)ethyl]propanamide Openeye Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenylpyrazol-4-yl)ethyl]propanamide CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenyl-4-pyrazolyl)ethyl]propanamide IUPAC Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenylpyrazol-4-yl)ethyl]propanamide Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(1-phenylpyrazol-4-yl)ethyl]propionamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CN(N=C1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CN(N=C1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H25N5O4S/c1-16(26-32(30,31)21-10-8-19(9-11-21)25-17(2)28)22(29)23-13-12-18-14-24-27(15-18)20-6-4-3-5-7-20/h3-11,14-16,26H,12-13H2,1-2H3,(H,23,29)(H,25,28)/t16-/m0/s1