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

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(sulfanylidene)methyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H29N3O5S2 MolecularWeight: 455.59136

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)N2CCC3(CC2)OCCO3)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)N2CCC3(CC2)OCCO3)C(=O)OC)C

InChI

InChI=1S/C20H29N3O5S2/c1-5-22(6-2)17(24)15-13(3)14(18(25)26-4)16(30-15)21-19(29)23-9-7-20(8-10-23)27-11-12-28-20/h5-12H2,1-4H3,(H,21,29)