5-(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-N-benzyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-N-benzyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-1,3,4-thiadiazol-2-yl]-benzyl-amine Formula: C12H13N7S2 MolecularWeight: 319.40852

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C2=NN=C(S2)NCC3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C(=N1)N)C2=NN=C(S2)NCC3=CC=CC=C3

InChI

InChI=1S/C12H13N7S2/c1-20-11-15-9(13)19(18-11)12-17-16-10(21-12)14-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,14,16)(H2,13,15,18)