5-chloranyl-N-[2-(diethylamino)-2-phenyl-ethyl]-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(diethylamino)-2-phenyl-ethyl]-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[2-(diethylamino)-2-phenyl-ethyl]-1-isobutyl-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(diethylamino)-2-phenylethyl]-3-methyl-1-(2-methylpropyl)-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[2-(diethylamino)-2-phenylethyl]-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxamide Traditional Name: 5-chloro-N-[2-(diethylamino)-2-phenyl-ethyl]-1-isobutyl-3-methyl-pyrazole-4-carboxamide Formula: C21H31ClN4O MolecularWeight: 390.95004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(N(N=C1C)CC(C)C)Cl)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(N(N=C1C)CC(C)C)Cl)C2=CC=CC=C2

InChI

InChI=1S/C21H31ClN4O/c1-6-25(7-2)18(17-11-9-8-10-12-17)13-23-21(27)19-16(5)24-26(20(19)22)14-15(3)4/h8-12,15,18H,6-7,13-14H2,1-5H3,(H,23,27)