2-chloranyl-4-methyl-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-4-methyl-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 2-chloro-4-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 2-chloro-4-methyl-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-4-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 2-chloro-N-(isonicotinamidothiocarbamoyl)-4-methyl-benzamide Formula: C15H13ClN4O2S MolecularWeight: 348.80732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=NC=C2)Cl

InChI

InChI=1S/C15H13ClN4O2S/c1-9-2-3-11(12(16)8-9)14(22)18-15(23)20-19-13(21)10-4-6-17-7-5-10/h2-8H,1H3,(H,19,21)(H2,18,20,22,23)