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

Systemtic Name: methyl 5-(dimethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(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-(dimethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H25N3O5S2 MolecularWeight: 427.5382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCC3(CC2)OCCO3)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCC3(CC2)OCCO3)C(=O)N(C)C

InChI

InChI=1S/C18H25N3O5S2/c1-11-12(16(23)24-4)14(28-13(11)15(22)20(2)3)19-17(27)21-7-5-18(6-8-21)25-9-10-26-18/h5-10H2,1-4H3,(H,19,27)