dimethyl 2-(pyrrolidin-1-ylcarbothioylamino)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(pyrrolidin-1-ylcarbothioylamino)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-(pyrrolidine-1-carbothioylamino)benzene-1,4-dicarboxylate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(pyrrolidine-1-carbothioylamino)benzene-1,4-dicarboxylate Traditional Name: 2-(pyrrolidine-1-carbothioylamino)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCCC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCCC2

InChI

InChI=1S/C15H18N2O4S/c1-20-13(18)10-5-6-11(14(19)21-2)12(9-10)16-15(22)17-7-3-4-8-17/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,22)