ethyl 3-[(2,4-dimethoxyphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(2,4-dimethoxyphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propanoate Openeye Name: ethyl 3-[(2,4-dimethoxyphenyl)carbamothioyl-(2-furylmethyl)amino]propanoate CAS Name: 3-[[(2,4-dimethoxyanilino)-sulfanylidenemethyl]-(2-furanylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-dimethoxyphenyl)carbamothioyl-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[(2,4-dimethoxyphenyl)thiocarbamoyl-(2-furfuryl)amino]propionic acid ethyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C19H24N2O5S/c1-4-25-18(22)9-10-21(13-15-6-5-11-26-15)19(27)20-16-8-7-14(23-2)12-17(16)24-3/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,20,27)