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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)CN(C)C)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)CN(C)C)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H25ClN4O/c1-16-20(21(23)27(25-16)15-18-7-5-4-6-8-18)22(28)24-13-17-9-11-19(12-10-17)14-26(2)3/h4-12H,13-15H2,1-3H3,(H,24,28)