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

Systemtic Name: N-[5-[(3-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-[(3-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide CAS Name: N-[5-[(3-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-[(3-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-[(3-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]butyramide Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NN=C(S1)SCC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCC(=O)NC1=NN=C(S1)SCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H14N4OS2/c1-2-4-12(19)16-13-17-18-14(21-13)20-9-11-6-3-5-10(7-11)8-15/h3,5-7H,2,4,9H2,1H3,(H,16,17,19)