2-chloranyl-N-[(4-methoxyphenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[(4-methoxyphenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[(4-methoxyphenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[(4-methoxyanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[(4-methoxyphenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[(4-methoxyphenyl)thiocarbamoyl]nicotinamide Formula: C14H12ClN3O2S MolecularWeight: 321.78198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C14H12ClN3O2S/c1-20-10-6-4-9(5-7-10)17-14(21)18-13(19)11-3-2-8-16-12(11)15/h2-8H,1H3,(H2,17,18,19,21)