N-tert-butyl-5-[oxidanyl(phenyl)methyl]pyridazine-3-carbothioamide

Systemtic Name: N-tert-butyl-5-[oxidanyl(phenyl)methyl]pyridazine-3-carbothioamide Openeye Name: N-tert-butyl-5-[hydroxy(phenyl)methyl]pyridazine-3-carbothioamide CAS Name: N-tert-butyl-5-[hydroxy(phenyl)methyl]-3-pyridazinecarbothioamide IUPAC Name: N-tert-butyl-5-[hydroxy(phenyl)methyl]pyridazine-3-carbothioamide Traditional Name: N-tert-butyl-5-[hydroxy(phenyl)methyl]pyridazine-3-carbothioamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)C1=NN=CC(=C1)C(C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)NC(=S)C1=NN=CC(=C1)C(C2=CC=CC=C2)O

InChI

InChI=1S/C16H19N3OS/c1-16(2,3)18-15(21)13-9-12(10-17-19-13)14(20)11-7-5-4-6-8-11/h4-10,14,20H,1-3H3,(H,18,21)