4-[2-[[2-chloranyl-5-(dimethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[2-chloranyl-5-(dimethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[2-chloro-5-(dimethylcarbamoyl)anilino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[2-chloro-5-[dimethylamino(oxo)methyl]anilino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[2-chloro-5-(dimethylcarbamoyl)anilino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[2-chloro-5-(dimethylcarbamoyl)anilino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C18H17ClN4O5S MolecularWeight: 436.86938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O5S/c1-22(2)18(26)11-3-5-12(19)13(7-11)21-16(24)9-29-15-6-4-10(17(20)25)8-14(15)23(27)28/h3-8H,9H2,1-2H3,(H2,20,25)(H,21,24)