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

Systemtic Name: 5-chloranyl-3-methyl-N-[3-[methyl(phenyl)amino]propyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-[3-(N-methylanilino)propyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[3-(N-methylanilino)propyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[3-(N-methylanilino)propyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-[3-(N-methylanilino)propyl]pyrazole-4-carboxamide Formula: C22H25ClN4O MolecularWeight: 396.9131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCN(C)C2=CC=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCN(C)C2=CC=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H25ClN4O/c1-17-20(21(23)27(25-17)16-18-10-5-3-6-11-18)22(28)24-14-9-15-26(2)19-12-7-4-8-13-19/h3-8,10-13H,9,14-16H2,1-2H3,(H,24,28)