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

Systemtic Name: 3-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 3-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C13H14N4S2 MolecularWeight: 290.40706

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCNC1=NN=C(S1)SCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H14N4S2/c1-2-6-15-12-16-17-13(19-12)18-9-11-5-3-4-10(7-11)8-14/h3-5,7H,2,6,9H2,1H3,(H,15,16)