dimethyl 2-[(3,5-dimethylpiperidin-1-yl)carbothioylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(3,5-dimethylpiperidin-1-yl)carbothioylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(3,5-dimethylpiperidine-1-carbothioyl)amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(3,5-dimethyl-1-piperidinyl)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(3,5-dimethylpiperidine-1-carbothioyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(3,5-dimethylpiperidine-1-carbothioyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=S)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)C

Isomeric SMILES

CC1CC(CN(C1)C(=S)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)C

InChI

InChI=1S/C18H24N2O4S/c1-11-7-12(2)10-20(9-11)18(25)19-15-8-13(16(21)23-3)5-6-14(15)17(22)24-4/h5-6,8,11-12H,7,9-10H2,1-4H3,(H,19,25)