(2-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3-chloranylbenzoate

Systemtic Name: (2-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3-chloranylbenzoate Openeye Name: [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-ethoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C20H20ClNO4S MolecularWeight: 405.8951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=S)N2CCOCC2)OC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=S)N2CCOCC2)OC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClNO4S/c1-2-25-18-13-14(19(27)22-8-10-24-11-9-22)6-7-17(18)26-20(23)15-4-3-5-16(21)12-15/h3-7,12-13H,2,8-11H2,1H3