1-methyl-3-[2-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)ethyl]thiourea

Systemtic Name: 1-methyl-3-[2-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)ethyl]thiourea Openeye Name: 1-methyl-3-[2-(6-oxo-3-phenyl-pyridazin-1-yl)ethyl]thiourea CAS Name: 1-methyl-3-[2-(6-oxo-3-phenyl-1-pyridazinyl)ethyl]thiourea IUPAC Name: 1-methyl-3-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]thiourea Traditional Name: 1-[2-(6-keto-3-phenyl-pyridazin-1-yl)ethyl]-3-methyl-thiourea Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCN1C(=O)C=CC(=N1)C2=CC=CC=C2

Isomeric SMILES

CNC(=S)NCCN1C(=O)C=CC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4OS/c1-15-14(20)16-9-10-18-13(19)8-7-12(17-18)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H2,15,16,20)