3-(2-dimethylaminoethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indol-8-amine

Systemtic Name: 3-(2-dimethylaminoethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indol-8-amine Openeye Name: 3-(2-dimethylaminoethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indol-8-amine CAS Name: 3-(2-dimethylaminoethylthio)-5H-[1,2,4]triazino[5,6-b]indol-8-amine IUPAC Name: 3-(2-dimethylaminoethylsulfanyl)-5H-[1,2,4]triazino[5,6-b]indol-8-amine Traditional Name: 2-[(8-amino-5H-[1,2,4]triazin[5,6-b]indol-3-yl)thio]ethyl-dimethyl-amine Formula: C13H16N6S MolecularWeight: 288.37134

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=C(C3=C(N2)C=CC(=C3)N)N=N1

Isomeric SMILES

CN(C)CCSC1=NC2=C(C3=C(N2)C=CC(=C3)N)N=N1

InChI

InChI=1S/C13H16N6S/c1-19(2)5-6-20-13-16-12-11(17-18-13)9-7-8(14)3-4-10(9)15-12/h3-4,7H,5-6,14H2,1-2H3,(H,15,16,18)