ethyl 4-[[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(tert-butylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(tert-butylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H25N5O2S2 MolecularWeight: 359.5106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CN2C(=S)SC(=N2)NC(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CN2C(=S)SC(=N2)NC(C)(C)C

InChI

InChI=1S/C14H25N5O2S2/c1-5-21-12(20)18-8-6-17(7-9-18)10-19-13(22)23-11(16-19)15-14(2,3)4/h5-10H2,1-4H3,(H,15,16)