4-[2-[[4-(dimethylcarbamoyl)phenyl]methylamino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[4-(dimethylcarbamoyl)phenyl]methylamino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[[4-(dimethylcarbamoyl)phenyl]methylamino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[[4-[dimethylamino(oxo)methyl]phenyl]methylamino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[[4-(dimethylcarbamoyl)phenyl]methylamino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[[4-(dimethylcarbamoyl)benzyl]amino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O5S/c1-22(2)19(26)13-5-3-12(4-6-13)10-21-17(24)11-29-16-8-7-14(18(20)25)9-15(16)23(27)28/h3-9H,10-11H2,1-2H3,(H2,20,25)(H,21,24)