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

Systemtic Name: methyl 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbothioylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(sulfanylidene)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioylamino)-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H22N2O4S2 MolecularWeight: 370.48688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4S2/c1-10-11(2)24-13(12(10)14(19)20-3)17-15(23)18-6-4-16(5-7-18)21-8-9-22-16/h4-9H2,1-3H3,(H,17,23)