O-[5-(4,6-ditert-butyl-5-oxidanylidene-pyrimidin-2-ylidene)-1,3,4-thiadiazolidin-2-yl] methanethioate

Systemtic Name: O-[5-(4,6-ditert-butyl-5-oxidanylidene-pyrimidin-2-ylidene)-1,3,4-thiadiazolidin-2-yl] methanethioate Openeye Name: O-[5-(4,6-ditert-butyl-5-oxo-pyrimidin-2-ylidene)-1,3,4-thiadiazolidin-2-yl] methanethioate CAS Name: methanethioic acid O-[5-(4,6-ditert-butyl-5-oxo-2-pyrimidinylidene)-1,3,4-thiadiazolidin-2-yl] ester IUPAC Name: O-[5-(4,6-ditert-butyl-5-oxopyrimidin-2-ylidene)-1,3,4-thiadiazolidin-2-yl] methanethioate Traditional Name: methanethioic acid O-[5-(4,6-ditert-butyl-5-keto-pyrimidin-2-ylidene)-1,3,4-thiadiazolidin-2-yl] ester Formula: C15H22N4O2S2 MolecularWeight: 354.49078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C2NNC(S2)OC=S)N=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=NC(=C2NNC(S2)OC=S)N=C(C1=O)C(C)(C)C

InChI

InChI=1S/C15H22N4O2S2/c1-14(2,3)9-8(20)10(15(4,5)6)17-11(16-9)12-18-19-13(23-12)21-7-22/h7,13,18-19H,1-6H3