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

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,3-diphenyl-propanamide Openeye Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,3-diphenyl-propanamide CAS Name: N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-3,3-diphenylpropanamide IUPAC Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,3-diphenylpropanamide Traditional Name: N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-3,3-diphenyl-propionamide Formula: C25H20N4OS2 MolecularWeight: 456.5825

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H20N4OS2/c26-16-18-11-13-19(14-12-18)17-31-25-29-28-24(32-25)27-23(30)15-22(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,22H,15,17H2,(H,27,28,30)