N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(5-chloro-2-methoxyphenyl)acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C22H20ClN3O2S2 MolecularWeight: 457.9961

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O2S2/c1-28-20-12-7-15(23)13-19(20)26-21(27)14-30-18-10-8-17(9-11-18)25-22(29)24-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,26,27)(H2,24,25,29)