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

Systemtic Name: 1-[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide Openeye Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide CAS Name: 1-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]phenyl]-5-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-carboxamide Traditional Name: 1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-5-(pyrrolidinomethyl)-1,2,4-triazole-3-carboxamide Formula: C21H19Cl2N5O2 MolecularWeight: 444.31386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=NC(=NN2C3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4Cl)C(=O)N

Isomeric SMILES

C1CCN(C1)CC2=NC(=NN2C3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4Cl)C(=O)N

InChI

InChI=1S/C21H19Cl2N5O2/c22-13-7-8-17(15(11-13)19(29)14-5-1-2-6-16(14)23)28-18(12-27-9-3-4-10-27)25-21(26-28)20(24)30/h1-2,5-8,11H,3-4,9-10,12H2,(H2,24,30)