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

Systemtic Name: 5-chloranyl-N-[2-(diethylamino)-3-phenyl-propyl]-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-[2-(diethylamino)-3-phenyl-propyl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(diethylamino)-3-phenylpropyl]-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-[2-(diethylamino)-3-phenylpropyl]-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-[2-(diethylamino)-3-phenyl-propyl]-3-methyl-pyrazole-4-carboxamide Formula: C25H31ClN4O MolecularWeight: 438.99284

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C25H31ClN4O/c1-4-29(5-2)22(16-20-12-8-6-9-13-20)17-27-25(31)23-19(3)28-30(24(23)26)18-21-14-10-7-11-15-21/h6-15,22H,4-5,16-18H2,1-3H3,(H,27,31)