N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-1,2,4-triazol-3-yl]-1-mesyl-isonipecotamide Formula: C16H19Cl2N5O3S MolecularWeight: 432.32476

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=NN(C=N2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=NN(C=N2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H19Cl2N5O3S/c1-27(25,26)23-6-4-12(5-7-23)15(24)20-16-19-10-22(21-16)9-11-2-3-13(17)14(18)8-11/h2-3,8,10,12H,4-7,9H2,1H3,(H,20,21,24)