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

Systemtic Name: N-[(2S)-butan-2-yl]-2-(3-chlorophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(3-chlorophenyl)-N-[(1S)-1-methylpropyl]-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-(3-chlorophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-(3-chlorophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(3-chlorophenyl)-N-[(1S)-1-methylpropyl]-5-(2-thienyl)pyrazole-3-carboxamide Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3OS/c1-3-12(2)20-18(23)16-11-15(17-8-5-9-24-17)21-22(16)14-7-4-6-13(19)10-14/h4-12H,3H2,1-2H3,(H,20,23)/t12-/m0/s1