N-[(2S)-butan-2-yl]-2-(2,5-dimethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-(2,5-dimethylphenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)-N-[(1S)-1-methylpropyl]-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-(2,5-dimethylphenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-(2,5-dimethylphenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(2,5-dimethylphenyl)-N-[(1S)-1-methylpropyl]-5-(2-thienyl)pyrazole-3-carboxamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NN1C2=C(C=CC(=C2)C)C)C3=CC=CS3

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=NN1C2=C(C=CC(=C2)C)C)C3=CC=CS3

InChI

InChI=1S/C20H23N3OS/c1-5-15(4)21-20(24)18-12-16(19-7-6-10-25-19)22-23(18)17-11-13(2)8-9-14(17)3/h6-12,15H,5H2,1-4H3,(H,21,24)/t15-/m0/s1