5-methyl-N-[(2-phenyl-1,3-benzodioxol-5-yl)carbamothioyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-[(2-phenyl-1,3-benzodioxol-5-yl)carbamothioyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-[(2-phenyl-1,3-benzodioxol-5-yl)carbamothioyl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-[[(2-phenyl-1,3-benzodioxol-5-yl)amino]-sulfanylidenemethyl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[(2-phenyl-1,3-benzodioxol-5-yl)carbamothioyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-methyl-N-[(2-phenyl-1,3-benzodioxol-5-yl)thiocarbamoyl]isoxazole-3-carboxamide Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(O3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(O3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O4S/c1-11-9-14(22-26-11)17(23)21-19(27)20-13-7-8-15-16(10-13)25-18(24-15)12-5-3-2-4-6-12/h2-10,18H,1H3,(H2,20,21,23,27)