N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-2,5-dimethoxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]-2,5-dimethoxyphenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-2,5-dimethoxy-phenyl]thiophene-2-carboxamide Formula: C22H22ClN3O5S2 MolecularWeight: 508.01018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OC)NC(=S)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OC)NC(=S)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C22H22ClN3O5S2/c1-28-16-11-19(31-4)13(8-12(16)23)25-22(32)26-15-10-17(29-2)14(9-18(15)30-3)24-21(27)20-6-5-7-33-20/h5-11H,1-4H3,(H,24,27)(H2,25,26,32)