5-(2-methyl-1,3-thiazol-4-yl)-N-[(3-phenoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(2-methyl-1,3-thiazol-4-yl)-N-[(3-phenoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(2-methylthiazol-4-yl)-N-[(3-phenoxyphenyl)carbamothioyl]isoxazole-3-carboxamide CAS Name: 5-(2-methyl-4-thiazolyl)-N-[(3-phenoxyanilino)-sulfanylidenemethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(2-methyl-1,3-thiazol-4-yl)-N-[(3-phenoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(2-methylthiazol-4-yl)-N-[(3-phenoxyphenyl)thiocarbamoyl]isoxazole-3-carboxamide Formula: C21H16N4O3S2 MolecularWeight: 436.50674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=NO2)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=NO2)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H16N4O3S2/c1-13-22-18(12-30-13)19-11-17(25-28-19)20(26)24-21(29)23-14-6-5-9-16(10-14)27-15-7-3-2-4-8-15/h2-12H,1H3,(H2,23,24,26,29)