4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(pyridin-4-ylmethyl)butanamide

Systemtic Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(pyridin-4-ylmethyl)butanamide Openeye Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(4-pyridylmethyl)butanamide CAS Name: 4-[(6-acetamido-3-pyridazinyl)thio]-N-(pyridin-4-ylmethyl)butanamide IUPAC Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(pyridin-4-ylmethyl)butanamide Traditional Name: 4-[(6-acetamidopyridazin-3-yl)thio]-N-(4-pyridylmethyl)butyramide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NCC2=CC=NC=C2

Isomeric SMILES

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C16H19N5O2S/c1-12(22)19-14-4-5-16(21-20-14)24-10-2-3-15(23)18-11-13-6-8-17-9-7-13/h4-9H,2-3,10-11H2,1H3,(H,18,23)(H,19,20,22)