(4-methylphenyl)sulfonyl N,N'-dipyridin-2-ylcarbamimidothioate

Systemtic Name: (4-methylphenyl)sulfonyl N,N'-dipyridin-2-ylcarbamimidothioate Openeye Name: 2-(p-tolylsulfonyl)-1,3-bis(2-pyridyl)isothiourea CAS Name: N,N'-bis(2-pyridinyl)carbamimidothioic acid (4-methylphenyl)sulfonyl ester IUPAC Name: (4-methylphenyl)sulfonyl N,N'-dipyridin-2-ylcarbamimidothioate Traditional Name: 1,3-bis(2-pyridyl)-2-tosyl-isothiourea Formula: C18H16N4O2S2 MolecularWeight: 384.47524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC(=NC2=CC=CC=N2)NC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)S/C(=N/C2=CC=CC=N2)/NC3=CC=CC=N3

InChI

InChI=1S/C18H16N4O2S2/c1-14-8-10-15(11-9-14)26(23,24)25-18(21-16-6-2-4-12-19-16)22-17-7-3-5-13-20-17/h2-13H,1H3,(H,19,20,21,22)