6-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C13H19N9S MolecularWeight: 333.41526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C13H19N9S/c14-10-16-9(17-11(15)18-10)7-23-13-20-19-12(21-5-1-2-6-21)22(13)8-3-4-8/h8H,1-7H2,(H4,14,15,16,17,18)