N-(4-methyl-1,3-thiazol-2-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-methylthiazol-2-yl)-2-[6-[4-(1-piperidyl)phenyl]pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-methyl-2-thiazolyl)-2-[[6-[4-(1-piperidinyl)phenyl]-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[6-(4-piperidin-1-ylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-methylthiazol-2-yl)-2-[[6-(4-piperidinophenyl)pyridazin-3-yl]thio]acetamide Formula: C21H23N5OS2 MolecularWeight: 425.57022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C21H23N5OS2/c1-15-13-29-21(22-15)23-19(27)14-28-20-10-9-18(24-25-20)16-5-7-17(8-6-16)26-11-3-2-4-12-26/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,23,27)