4-(2-azanylethyl)-5-(methylsulfanylmethyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(2-azanylethyl)-5-(methylsulfanylmethyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(2-aminoethyl)-5-(methylsulfanylmethyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(2-aminoethyl)-5-[(methylthio)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-(2-aminoethyl)-5-(methylsulfanylmethyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(2-aminoethyl)-5-[(methylthio)methyl]-3-pyrazolin-3-one Formula: C7H13N3OS MolecularWeight: 187.26262

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=C(C(=O)NN1)CCN

Isomeric SMILES

CSCC1=C(C(=O)NN1)CCN

InChI

InChI=1S/C7H13N3OS/c1-12-4-6-5(2-3-8)7(11)10-9-6/h2-4,8H2,1H3,(H2,9,10,11)