dimethyl 2-(3-methoxypropylcarbamothioylamino)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(3-methoxypropylcarbamothioylamino)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-(3-methoxypropylcarbamothioylamino)benzene-1,4-dicarboxylate CAS Name: 2-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-methoxypropylcarbamothioylamino)benzene-1,4-dicarboxylate Traditional Name: 2-(3-methoxypropylthiocarbamoylamino)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

COCCCNC(=S)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C15H20N2O5S/c1-20-8-4-7-16-15(23)17-12-9-10(13(18)21-2)5-6-11(12)14(19)22-3/h5-6,9H,4,7-8H2,1-3H3,(H2,16,17,23)