1-butyl-5-chloranyl-3-methyl-N-[(1R)-1-phenylethyl]pyrazole-4-carboxamide

Systemtic Name: 1-butyl-5-chloranyl-3-methyl-N-[(1R)-1-phenylethyl]pyrazole-4-carboxamide Openeye Name: 1-butyl-5-chloro-3-methyl-N-[(1R)-1-phenylethyl]pyrazole-4-carboxamide CAS Name: 1-butyl-5-chloro-3-methyl-N-[(1R)-1-phenylethyl]-4-pyrazolecarboxamide IUPAC Name: 1-butyl-5-chloro-3-methyl-N-[(1R)-1-phenylethyl]pyrazole-4-carboxamide Traditional Name: 1-butyl-5-chloro-3-methyl-N-[(1R)-1-phenylethyl]pyrazole-4-carboxamide Formula: C17H22ClN3O MolecularWeight: 319.82908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NC(C)C2=CC=CC=C2)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)N[C@H](C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C17H22ClN3O/c1-4-5-11-21-16(18)15(13(3)20-21)17(22)19-12(2)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3,(H,19,22)/t12-/m1/s1