1-[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-N-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-N-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide Openeye Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide CAS Name: 1-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]phenyl]-N-methyl-5-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide Traditional Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N-methyl-5-(pyrrolidinomethyl)-1,2,4-triazole-3-carboxamide Formula: C22H21Cl2N5O2 MolecularWeight: 458.34044

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=N1)CN2CCCC2)C3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CNC(=O)C1=NN(C(=N1)CN2CCCC2)C3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H21Cl2N5O2/c1-25-22(31)21-26-19(13-28-10-4-5-11-28)29(27-21)18-9-8-14(23)12-16(18)20(30)15-6-2-3-7-17(15)24/h2-3,6-9,12H,4-5,10-11,13H2,1H3,(H,25,31)