N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloranyl-N,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloranyl-N,3-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloro-N,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloro-N,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloro-N,3-dimethylpyrazole-4-carboxamide Traditional Name: N-[1-(3-benzamidophenyl)ethyl]-1-butyl-5-chloro-N,3-dimethyl-pyrazole-4-carboxamide Formula: C25H29ClN4O2 MolecularWeight: 452.97636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)N(C)C(C)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)N(C)C(C)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C25H29ClN4O2/c1-5-6-15-30-23(26)22(17(2)28-30)25(32)29(4)18(3)20-13-10-14-21(16-20)27-24(31)19-11-8-7-9-12-19/h7-14,16,18H,5-6,15H2,1-4H3,(H,27,31)