2-[(4-methylsulfonylphenyl)amino]pyridine-4-carbothioamide

Systemtic Name: 2-[(4-methylsulfonylphenyl)amino]pyridine-4-carbothioamide Openeye Name: 2-(4-methylsulfonylanilino)pyridine-4-carbothioamide CAS Name: 2-(4-methylsulfonylanilino)-4-pyridinecarbothioamide IUPAC Name: 2-(4-methylsulfonylanilino)pyridine-4-carbothioamide Traditional Name: 2-(4-mesylanilino)thioisonicotinamide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=C2)C(=S)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=C2)C(=S)N

InChI

InChI=1S/C13H13N3O2S2/c1-20(17,18)11-4-2-10(3-5-11)16-12-8-9(13(14)19)6-7-15-12/h2-8H,1H3,(H2,14,19)(H,15,16)