diethyl 5-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(sulfanylidene)methyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H26N2O6S2 MolecularWeight: 442.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCC3(CC2)OCCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCC3(CC2)OCCO3

InChI

InChI=1S/C19H26N2O6S2/c1-4-24-16(22)13-12(3)14(17(23)25-5-2)29-15(13)20-18(28)21-8-6-19(7-9-21)26-10-11-27-19/h4-11H2,1-3H3,(H,20,28)