3-[[5-[(2,6-diethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-[(2,6-diethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-(2,6-diethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-(2,6-diethylanilino)-1,3,4-thiadiazol-2-yl]thio]propanenitrile IUPAC Name: 3-[[5-(2,6-diethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-(2,6-diethylanilino)-1,3,4-thiadiazol-2-yl]thio]propionitrile Formula: C15H18N4S2 MolecularWeight: 318.46022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC2=NN=C(S2)SCCC#N

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC2=NN=C(S2)SCCC#N

InChI

InChI=1S/C15H18N4S2/c1-3-11-7-5-8-12(4-2)13(11)17-14-18-19-15(21-14)20-10-6-9-16/h5,7-8H,3-4,6,10H2,1-2H3,(H,17,18)