carbamothioyl N-[2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethyl-carbamate

Systemtic Name: carbamothioyl N-[2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethyl-carbamate Openeye Name: carbamothioyl N-[2-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethyl-carbamate CAS Name: N-[2-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethylcarbamic acid carbamothioyl ester IUPAC Name: carbamothioyl N-[2-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethylcarbamate Traditional Name: N-[2-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-thiadiazol-5-yl]-N-ethyl-carbamic acid thiocarbamoyl ester Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NNC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)S1)C(=O)OC(=S)N

Isomeric SMILES

CCN(C1=NNC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)S1)C(=O)OC(=S)N

InChI

InChI=1S/C20H28N4O3S2/c1-8-24(18(26)27-16(21)28)17-23-22-15(29-17)11-9-12(19(2,3)4)14(25)13(10-11)20(5,6)7/h9-10,22H,8H2,1-7H3,(H2,21,28)