N-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[4-(3-nitrophenyl)thiazol-2-yl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[[4-(3-nitrophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[4-(3-nitrophenyl)thiazol-2-yl]thiocarbamoyl]-2-phenoxy-acetamide Formula: C18H14N4O4S2 MolecularWeight: 414.45816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4S2/c23-16(10-26-14-7-2-1-3-8-14)20-17(27)21-18-19-15(11-28-18)12-5-4-6-13(9-12)22(24)25/h1-9,11H,10H2,(H2,19,20,21,23,27)