4-azanyl-5-propan-2-yl-2-(2-sulfanylethyl)-1,2,4-triazol-3-one

Systemtic Name: 4-azanyl-5-propan-2-yl-2-(2-sulfanylethyl)-1,2,4-triazol-3-one Openeye Name: 4-amino-5-isopropyl-2-(2-sulfanylethyl)-1,2,4-triazol-3-one CAS Name: 4-amino-2-(2-mercaptoethyl)-5-propan-2-yl-1,2,4-triazol-3-one IUPAC Name: 4-amino-5-propan-2-yl-2-(2-sulfanylethyl)-1,2,4-triazol-3-one Traditional Name: 4-amino-5-isopropyl-2-(2-mercaptoethyl)-1,2,4-triazol-3-one Formula: C7H14N4OS MolecularWeight: 202.27726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=O)N1N)CCS

Isomeric SMILES

CC(C)C1=NN(C(=O)N1N)CCS

InChI

InChI=1S/C7H14N4OS/c1-5(2)6-9-10(3-4-13)7(12)11(6)8/h5,13H,3-4,8H2,1-2H3