dimethyl 3-methyl-5-(pyrrolidin-1-ylcarbothioylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(pyrrolidin-1-ylcarbothioylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-(pyrrolidine-1-carbothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-pyrrolidinyl(sulfanylidene)methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-(pyrrolidine-1-carbothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(pyrrolidine-1-carbothioylamino)thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H18N2O4S2 MolecularWeight: 342.43372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCCC2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCCC2)C(=O)OC

InChI

InChI=1S/C14H18N2O4S2/c1-8-9(12(17)19-2)11(22-10(8)13(18)20-3)15-14(21)16-6-4-5-7-16/h4-7H2,1-3H3,(H,15,21)