5-methyl-3-phenyl-N-[(pyrazin-2-ylcarbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-3-phenyl-N-[(pyrazin-2-ylcarbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide Openeye Name: 5-methyl-3-phenyl-N-[(pyrazine-2-carbonylamino)carbamothioyl]isoxazole-4-carboxamide CAS Name: 5-methyl-N-[[[oxo(2-pyrazinyl)methyl]hydrazo]-sulfanylidenemethyl]-3-phenyl-4-isoxazolecarboxamide IUPAC Name: 5-methyl-3-phenyl-N-[(pyrazine-2-carbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide Traditional Name: 5-methyl-3-phenyl-N-[(pyrazinoylamino)thiocarbamoyl]isoxazole-4-carboxamide Formula: C17H14N6O3S MolecularWeight: 382.39646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N6O3S/c1-10-13(14(23-26-10)11-5-3-2-4-6-11)16(25)20-17(27)22-21-15(24)12-9-18-7-8-19-12/h2-9H,1H3,(H,21,24)(H2,20,22,25,27)