5-chloranyl-3-methyl-1-(phenylmethyl)-N-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(phenylmethyl)-N-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-N-[4-(1-pyrrolidinyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(4-pyrrolidinophenyl)pyrazole-4-carboxamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)N3CCCC3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)N3CCCC3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O/c1-16-20(21(23)27(25-16)15-17-7-3-2-4-8-17)22(28)24-18-9-11-19(12-10-18)26-13-5-6-14-26/h2-4,7-12H,5-6,13-15H2,1H3,(H,24,28)