1-[2-[(3-azanyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethyl]-3-methyl-thiourea

Systemtic Name: 1-[2-[(3-azanyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethyl]-3-methyl-thiourea Openeye Name: 1-[2-[(3-amino-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethyl]-3-methyl-thiourea CAS Name: 1-[2-[(3-amino-1H-1,2,4-triazol-5-yl)methylthio]ethyl]-3-methylthiourea IUPAC Name: 1-[2-[(3-amino-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethyl]-3-methylthiourea Traditional Name: 1-[2-[(3-amino-1H-1,2,4-triazol-5-yl)methylthio]ethyl]-3-methyl-thiourea Formula: C7H14N6S2 MolecularWeight: 246.35626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCSCC1=NC(=NN1)N

Isomeric SMILES

CNC(=S)NCCSCC1=NC(=NN1)N

InChI

InChI=1S/C7H14N6S2/c1-9-7(14)10-2-3-15-4-5-11-6(8)13-12-5/h2-4H2,1H3,(H2,9,10,14)(H3,8,11,12,13)