(2-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3,4-dimethoxybenzoate

Systemtic Name: (2-ethoxy-4-morpholin-4-ylcarbothioyl-phenyl) 3,4-dimethoxybenzoate Openeye Name: [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-ethoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-ethoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO6S/c1-4-28-20-13-15(21(30)23-9-11-27-12-10-23)5-8-18(20)29-22(24)16-6-7-17(25-2)19(14-16)26-3/h5-8,13-14H,4,9-12H2,1-3H3