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

Systemtic Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide Openeye Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propanamide CAS Name: N-[5-[(2-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide IUPAC Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-N-cyclopropylpropanamide Traditional Name: N-[5-[(2-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-propionamide Formula: C16H16N4OS2 MolecularWeight: 344.45444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C16H16N4OS2/c1-2-14(21)20(13-7-8-13)15-18-19-16(23-15)22-10-12-6-4-3-5-11(12)9-17/h3-6,13H,2,7-8,10H2,1H3