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

Systemtic Name: 5-chloranyl-N-[2-(diethylamino)-2-phenyl-ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[2-(diethylamino)-2-phenyl-ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(diethylamino)-2-phenylethyl]-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[2-(diethylamino)-2-phenylethyl]-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[2-(diethylamino)-2-phenyl-ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C23H27ClN4O MolecularWeight: 410.93968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C23H27ClN4O/c1-4-27(5-2)20(18-12-8-6-9-13-18)16-25-23(29)21-17(3)26-28(22(21)24)19-14-10-7-11-15-19/h6-15,20H,4-5,16H2,1-3H3,(H,25,29)