(2-morpholin-4-ylcarbothioylphenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-morpholin-4-ylcarbothioylphenyl) 4-methylbenzenesulfonate Openeye Name: [2-(morpholine-4-carbothioyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[4-morpholinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-(morpholine-4-carbothioyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(morpholine-4-carbothioyl)phenyl] ester Formula: C18H19NO4S2 MolecularWeight: 377.47776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(=S)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(=S)N3CCOCC3

InChI

InChI=1S/C18H19NO4S2/c1-14-6-8-15(9-7-14)25(20,21)23-17-5-3-2-4-16(17)18(24)19-10-12-22-13-11-19/h2-9H,10-13H2,1H3