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

Systemtic Name: 2-(4-chloranylphenoxy)-N-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[[4-(3-nitrophenyl)thiazol-2-yl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[[[4-(3-nitrophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[[4-(3-nitrophenyl)thiazol-2-yl]thiocarbamoyl]acetamide Formula: C18H13ClN4O4S2 MolecularWeight: 448.90322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC(=S)NC(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC(=S)NC(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H13ClN4O4S2/c19-12-4-6-14(7-5-12)27-9-16(24)21-17(28)22-18-20-15(10-29-18)11-2-1-3-13(8-11)23(25)26/h1-8,10H,9H2,(H2,20,21,22,24,28)