diethyl 3-methyl-5-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]carbothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]carbothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazinyl]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[4-[(2R)-oxolane-2-carbonyl]piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H29N3O6S2 MolecularWeight: 483.60146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCN(CC2)C(=O)C3CCCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2CCN(CC2)C(=O)[C@H]3CCCO3

InChI

InChI=1S/C21H29N3O6S2/c1-4-28-19(26)15-13(3)16(20(27)29-5-2)32-17(15)22-21(31)24-10-8-23(9-11-24)18(25)14-7-6-12-30-14/h14H,4-12H2,1-3H3,(H,22,31)/t14-/m1/s1