N-[[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]methylideneamino]-3,5-dimethoxy-benzamide

Systemtic Name: N-[[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]methylideneamino]-3,5-dimethoxy-benzamide Openeye Name: N-[[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]methyleneamino]-3,5-dimethoxy-benzamide CAS Name: N-[[2-[(4-chlorophenyl)thio]-5-nitrophenyl]methylideneamino]-3,5-dimethoxybenzamide IUPAC Name: N-[[2-(4-chlorophenyl)sulfanyl-5-nitrophenyl]methylideneamino]-3,5-dimethoxybenzamide Traditional Name: N-[[2-[(4-chlorophenyl)thio]-5-nitro-benzylidene]amino]-3,5-dimethoxy-benzamide Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H18ClN3O5S/c1-30-18-10-14(11-19(12-18)31-2)22(27)25-24-13-15-9-17(26(28)29)5-8-21(15)32-20-6-3-16(23)4-7-20/h3-13H,1-2H3,(H,25,27)