N-(4-ethylphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide

Systemtic Name: N-(4-ethylphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-(4-ethylphenyl)-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(4-ethylphenyl)-4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-(4-ethylphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-(4-ethylphenyl)-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4

InChI

InChI=1S/C21H23N5OS/c1-2-16-5-7-17(8-6-16)22-21(27)26-13-11-25(12-14-26)20-10-9-18(23-24-20)19-4-3-15-28-19/h3-10,15H,2,11-14H2,1H3,(H,22,27)