N-[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]-1,3-dithiolan-2-imine

Systemtic Name: N-[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]-1,3-dithiolan-2-imine Openeye Name: N-(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-1,3-dithiolan-2-imine CAS Name: N-[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]-1,3-dithiolan-2-imine IUPAC Name: N-(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-1,3-dithiolan-2-imine Traditional Name: [4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]-(1,3-dithiolan-2-ylidene)amine Formula: C13H14N4S3 MolecularWeight: 322.47206

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)N=C3SCCS3

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)N=C3SCCS3

InChI

InChI=1S/C13H14N4S3/c1-18-12-16-15-11(14-13-19-7-8-20-13)17(12)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3