3-chloranyl-4-methoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-4-methoxy-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[(pyridine-4-carbonylamino)carbamothioyl]benzamide Traditional Name: 3-chloro-N-(isonicotinamidothiocarbamoyl)-4-methoxy-benzamide Formula: C15H13ClN4O3S MolecularWeight: 364.80672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClN4O3S/c1-23-12-3-2-10(8-11(12)16)13(21)18-15(24)20-19-14(22)9-4-6-17-7-5-9/h2-8H,1H3,(H,19,22)(H2,18,20,21,24)