N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-[3-(ethylthio)-1,2,4-thiadiazol-5-yl]-2-phenylacetamide IUPAC Name: N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-[3-(ethylthio)-1,2,4-thiadiazol-5-yl]-2-phenyl-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C25H23N5OS4 MolecularWeight: 537.74302

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NSC(=N1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

CCSC1=NSC(=N1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H23N5OS4/c1-2-33-25-29-24(35-30-25)28-22(31)21(17-9-5-3-6-10-17)34-20-15-13-19(14-16-20)27-23(32)26-18-11-7-4-8-12-18/h3-16,21H,2H2,1H3,(H2,26,27,32)(H,28,29,30,31)