1-thiophen-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one

Systemtic Name: 1-thiophen-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one Openeye Name: 1-(2-thienyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one CAS Name: 1-thiophen-2-yl-4-(1H-1,2,4-triazol-5-ylthio)-1-butanone IUPAC Name: 1-thiophen-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one Traditional Name: 1-(2-thienyl)-4-(1H-1,2,4-triazol-5-ylthio)butan-1-one Formula: C10H11N3OS2 MolecularWeight: 253.34384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CCCSC2=NC=NN2

Isomeric SMILES

C1=CSC(=C1)C(=O)CCCSC2=NC=NN2

InChI

InChI=1S/C10H11N3OS2/c14-8(9-4-2-5-15-9)3-1-6-16-10-11-7-12-13-10/h2,4-5,7H,1,3,6H2,(H,11,12,13)