4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile Openeye Name: 4-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile CAS Name: 4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]butanenitrile IUPAC Name: 4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanenitrile Traditional Name: 4-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]butyronitrile Formula: C12H14N4S3 MolecularWeight: 310.46136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC2=NN=C(S2)SCCCC#N

Isomeric SMILES

C1=CSC(=C1)CCNC2=NN=C(S2)SCCCC#N

InChI

InChI=1S/C12H14N4S3/c13-6-1-2-8-18-12-16-15-11(19-12)14-7-5-10-4-3-9-17-10/h3-4,9H,1-2,5,7-8H2,(H,14,15)