5-methyl-3-phenyl-N-[[[(1S,2S)-2-phenylcyclopropyl]carbonylamino]carbamothioyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-3-phenyl-N-[[[(1S,2S)-2-phenylcyclopropyl]carbonylamino]carbamothioyl]-1,2-oxazole-4-carboxamide Openeye Name: 5-methyl-3-phenyl-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]isoxazole-4-carboxamide CAS Name: 5-methyl-N-[[[oxo-[(1S,2S)-2-phenylcyclopropyl]methyl]hydrazo]-sulfanylidenemethyl]-3-phenyl-4-isoxazolecarboxamide IUPAC Name: 5-methyl-3-phenyl-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]-1,2-oxazole-4-carboxamide Traditional Name: 5-methyl-3-phenyl-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]thiocarbamoyl]isoxazole-4-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)[C@H]3C[C@@H]3C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3S/c1-13-18(19(26-29-13)15-10-6-3-7-11-15)21(28)23-22(30)25-24-20(27)17-12-16(17)14-8-4-2-5-9-14/h2-11,16-17H,12H2,1H3,(H,24,27)(H2,23,25,28,30)/t16-,17+/m1/s1