4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H14N4OS2/c1-18-7-6-15-12-16-17-13(20-12)19-9-11-4-2-10(8-14)3-5-11/h2-5H,6-7,9H2,1H3,(H,15,16)