(2-phenyl-1,2,3-triazol-4-yl)-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (2-phenyl-1,2,3-triazol-4-yl)-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone Openeye Name: (2-phenyltriazol-4-yl)-[4-[6-(2-thienyl)pyridazin-3-yl]piperazin-1-yl]methanone CAS Name: (2-phenyl-4-triazolyl)-[4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinyl]methanone IUPAC Name: (2-phenyltriazol-4-yl)-[4-(6-thiophen-2-ylpyridazin-3-yl)piperazin-1-yl]methanone Traditional Name: (2-phenyltriazol-4-yl)-[4-[6-(2-thienyl)pyridazin-3-yl]piperazino]methanone Formula: C21H19N7OS MolecularWeight: 417.48686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)C4=NN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=CS3)C(=O)C4=NN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C21H19N7OS/c29-21(18-15-22-28(25-18)16-5-2-1-3-6-16)27-12-10-26(11-13-27)20-9-8-17(23-24-20)19-7-4-14-30-19/h1-9,14-15H,10-13H2