4-azanyl-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxamide hydrate

Systemtic Name: 4-azanyl-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxamide hydrate Openeye Name: 4-amino-3-ethyl-2-thioxo-thiazole-5-carboxamide hydrate CAS Name: 4-amino-3-ethyl-2-sulfanylidene-5-thiazolecarboxamide hydrate IUPAC Name: 4-amino-3-ethyl-2-sulfanylidene-1,3-thiazole-5-carboxamide hydrate Traditional Name: 4-amino-3-ethyl-2-thioxo-4-thiazoline-5-carboxamide hydrate Formula: C6H11N3O2S2 MolecularWeight: 221.30044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(SC1=S)C(=O)N)N.O

Isomeric SMILES

CCN1C(=C(SC1=S)C(=O)N)N.O

InChI

InChI=1S/C6H9N3OS2.H2O/c1-2-9-4(7)3(5(8)10)12-6(9)11;/h2,7H2,1H3,(H2,8,10);1H2