N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]-5-phenyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]-5-phenyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]-5-phenyl-thiadiazole-4-carboxamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]phenyl]-5-phenyl-4-thiadiazolecarboxamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]phenyl]-5-phenylthiadiazole-4-carboxamide Traditional Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]phenyl]-5-phenyl-thiadiazole-4-carboxamide Formula: C24H20ClN5O3S2 MolecularWeight: 526.0303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)NC(=O)C3=C(SN=N3)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)NC(=O)C3=C(SN=N3)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C24H20ClN5O3S2/c1-32-19-13-20(33-2)18(12-17(19)25)28-24(34)27-16-10-8-15(9-11-16)26-23(31)21-22(35-30-29-21)14-6-4-3-5-7-14/h3-13H,1-2H3,(H,26,31)(H2,27,28,34)