2-[5-azanyl-3-(4-methylpiperazin-1-yl)-1,2,4-triazol-1-yl]-3-oxidanyl-propanethioamide

Systemtic Name: 2-[5-azanyl-3-(4-methylpiperazin-1-yl)-1,2,4-triazol-1-yl]-3-oxidanyl-propanethioamide Openeye Name: 2-[5-amino-3-(4-methylpiperazin-1-yl)-1,2,4-triazol-1-yl]-3-hydroxy-propanethioamide CAS Name: 2-[5-amino-3-(4-methyl-1-piperazinyl)-1,2,4-triazol-1-yl]-3-hydroxypropanethioamide IUPAC Name: 2-[5-amino-3-(4-methylpiperazin-1-yl)-1,2,4-triazol-1-yl]-3-hydroxypropanethioamide Traditional Name: 2-[5-amino-3-(4-methylpiperazino)-1,2,4-triazol-1-yl]-3-hydroxy-thiopropionamide Formula: C10H19N7OS MolecularWeight: 285.36916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NN(C(=N2)N)C(CO)C(=S)N

Isomeric SMILES

CN1CCN(CC1)C2=NN(C(=N2)N)C(CO)C(=S)N

InChI

InChI=1S/C10H19N7OS/c1-15-2-4-16(5-3-15)10-13-9(12)17(14-10)7(6-18)8(11)19/h7,18H,2-6H2,1H3,(H2,11,19)(H2,12,13,14)