6-chloranyl-N-[[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-N-[[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]carbamothioyl]pyridine-3-carboxamide Openeye Name: 6-chloro-N-[[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide CAS Name: 6-chloro-N-[[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 6-chloro-N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide Traditional Name: 6-chloro-N-[[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]thiocarbamoyl]nicotinamide Formula: C18H14ClN5O3S MolecularWeight: 415.85346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN5O3S/c1-10-14(15(24-27-10)11-5-3-2-4-6-11)17(26)22-23-18(28)21-16(25)12-7-8-13(19)20-9-12/h2-9H,1H3,(H,22,26)(H2,21,23,25,28)