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

Systemtic Name: N-(2,3-dimethylphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(2,3-dimethylphenyl)-4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-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:

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4)C

InChI

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