ethyl 3-[(3-chlorophenyl)carbonylcarbamothioyl-(furan-2-ylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(3-chlorophenyl)carbonylcarbamothioyl-(furan-2-ylmethyl)amino]propanoate Openeye Name: ethyl 3-[(3-chlorobenzoyl)carbamothioyl-(2-furylmethyl)amino]propanoate CAS Name: 3-[[[[(3-chlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]-(2-furanylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3-chlorobenzoyl)carbamothioyl-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[(3-chlorobenzoyl)thiocarbamoyl-(2-furfuryl)amino]propionic acid ethyl ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H19ClN2O4S/c1-2-24-16(22)8-9-21(12-15-7-4-10-25-15)18(26)20-17(23)13-5-3-6-14(19)11-13/h3-7,10-11H,2,8-9,12H2,1H3,(H,20,23,26)