4-(6-acetamidopyridazin-3-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]butanamide

Systemtic Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]butanamide Openeye Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-[4-(trifluoromethoxy)phenyl]butanamide CAS Name: 4-[(6-acetamido-3-pyridazinyl)thio]-N-[4-(trifluoromethoxy)phenyl]butanamide IUPAC Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-[4-(trifluoromethoxy)phenyl]butanamide Traditional Name: 4-[(6-acetamidopyridazin-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]butyramide Formula: C17H17F3N4O3S MolecularWeight: 414.40209

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C17H17F3N4O3S/c1-11(25)21-14-8-9-16(24-23-14)28-10-2-3-15(26)22-12-4-6-13(7-5-12)27-17(18,19)20/h4-9H,2-3,10H2,1H3,(H,22,26)(H,21,23,25)