N-[5-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide

Systemtic Name: N-[5-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide Openeye Name: N-[5-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide CAS Name: N-[5-[[4-(2-cyanophenyl)phenyl]methylthio]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide IUPAC Name: N-[5-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide Traditional Name: N-[5-[[4-(2-cyanophenyl)benzyl]thio]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propionamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H20N4OS2/c1-2-20(27)26(18-11-12-18)21-24-25-22(29-21)28-14-15-7-9-16(10-8-15)19-6-4-3-5-17(19)13-23/h3-10,18H,2,11-12,14H2,1H3