(2S)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: (2S)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: (2S)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-methyl-2-(2-thienylsulfonylamino)butanamide CAS Name: (2S)-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: (2S)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: (2S)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-methyl-2-(2-thienylsulfonylamino)butyramide Formula: C25H26N4O3S2 MolecularWeight: 494.62894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C25H26N4O3S2/c1-18(2)23(28-34(31,32)22-14-9-15-33-22)25(30)26-16-20-17-29(21-12-7-4-8-13-21)27-24(20)19-10-5-3-6-11-19/h3-15,17-18,23,28H,16H2,1-2H3,(H,26,30)/t23-/m0/s1