tert-butyl 7,11-dicyano-8-oxidanylidene-10-sulfanyl-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylate

Systemtic Name: tert-butyl 7,11-dicyano-8-oxidanylidene-10-sulfanyl-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylate Openeye Name: tert-butyl 7,11-dicyano-8-oxo-10-sulfanyl-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylate CAS Name: 7,11-dicyano-10-mercapto-8-oxo-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7,11-dicyano-8-oxo-10-sulfanyl-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylate Traditional Name: 7,11-dicyano-8-keto-10-mercapto-3,9-diazaspiro[5.5]undec-10-ene-3-carboxylic acid tert-butyl ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)C(C(=O)NC(=C2C#N)S)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C(C(=O)NC(=C2C#N)S)C#N

InChI

InChI=1S/C16H20N4O3S/c1-15(2,3)23-14(22)20-6-4-16(5-7-20)10(8-17)12(21)19-13(24)11(16)9-18/h10,24H,4-7H2,1-3H3,(H,19,21)