N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitro-benzamide Openeye Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[[4-(4-chlorophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]thiocarbamoyl]-3-nitro-benzamide Formula: C17H11ClN4O3S2 MolecularWeight: 418.87724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClN4O3S2/c18-12-6-4-10(5-7-12)14-9-27-17(19-14)21-16(26)20-15(23)11-2-1-3-13(8-11)22(24)25/h1-9H,(H2,19,20,21,23,26)