3-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[(E)-[1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)pyrazol-4-yl]methylideneamino]-5-(piperidin-1-ylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 3-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[(E)-[1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)pyrazol-4-yl]methylideneamino]-5-(piperidin-1-ylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)pyrazol-4-yl]methyleneamino]-5-(1-piperidylmethyl)triazole-4-carboxamide CAS Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-4-pyrazolyl]methylideneamino]-5-(1-piperidinylmethyl)-4-triazolecarboxamide IUPAC Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)pyrazol-4-yl]methylideneamino]-5-(piperidin-1-ylmethyl)triazole-4-carboxamide Traditional Name: 3-(4-aminofurazan-3-yl)-N-[(E)-[1-(4-bromobenzyl)-3-(4-chlorophenyl)pyrazol-4-yl]methyleneamino]-5-(piperidinomethyl)triazole-4-carboxamide Formula: C28H27BrClN11O2 MolecularWeight: 664.94348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(N(N=N2)C3=NON=C3N)C(=O)NN=CC4=CN(N=C4C5=CC=C(C=C5)Cl)CC6=CC=C(C=C6)Br

Isomeric SMILES

C1CCN(CC1)CC2=C(N(N=N2)C3=NON=C3N)C(=O)N/N=C/C4=CN(N=C4C5=CC=C(C=C5)Cl)CC6=CC=C(C=C6)Br

InChI

InChI=1S/C28H27BrClN11O2/c29-21-8-4-18(5-9-21)15-40-16-20(24(35-40)19-6-10-22(30)11-7-19)14-32-34-28(42)25-23(17-39-12-2-1-3-13-39)33-38-41(25)27-26(31)36-43-37-27/h4-11,14,16H,1-3,12-13,15,17H2,(H2,31,36)(H,34,42)/b32-14+