(2-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 2-methylbenzoate

Systemtic Name: (2-methoxy-4-morpholin-4-ylcarbothioyl-phenyl) 2-methylbenzoate Openeye Name: [2-methoxy-4-(morpholine-4-carbothioyl)phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [2-methoxy-4-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-(morpholine-4-carbothioyl)phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [2-methoxy-4-(morpholine-4-carbothioyl)phenyl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(=S)N3CCOCC3)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(=S)N3CCOCC3)OC

InChI

InChI=1S/C20H21NO4S/c1-14-5-3-4-6-16(14)20(22)25-17-8-7-15(13-18(17)23-2)19(26)21-9-11-24-12-10-21/h3-8,13H,9-12H2,1-2H3