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

Systemtic Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-ethanoylphenyl)-2-phenyl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-phenyl-acetamide CAS Name: N-(3-acetylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]-2-phenylacetamide IUPAC Name: N-(3-acetylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-phenylacetamide Traditional Name: N-(3-acetylphenyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]-2-phenyl-acetamide Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(S3)NC4CC4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(S3)NC4CC4

InChI

InChI=1S/C21H20N4O2S2/c1-13(26)15-8-5-9-17(12-15)22-19(27)18(14-6-3-2-4-7-14)28-21-25-24-20(29-21)23-16-10-11-16/h2-9,12,16,18H,10-11H2,1H3,(H,22,27)(H,23,24)