ethyl 4-[(4-morpholin-4-ylsulfonylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-morpholin-4-ylsulfonylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-morpholinosulfonylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-morpholin-4-ylsulfonylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-morpholinosulfonylphenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23N3O5S2/c1-2-28-19(24)15-3-5-16(6-4-15)21-20(29)22-17-7-9-18(10-8-17)30(25,26)23-11-13-27-14-12-23/h3-10H,2,11-14H2,1H3,(H2,21,22,29)