(2-phenylazanyl-1,3-thiazol-4-yl)methyl 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-anilinothiazol-4-yl)methyl 2,4-dichloro-5-morpholinosulfonyl-benzoate CAS Name: 2,4-dichloro-5-(4-morpholinylsulfonyl)benzoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 2,4-dichloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-morpholinosulfonyl-benzoic acid (2-anilinothiazol-4-yl)methyl ester Formula: C21H19Cl2N3O5S2 MolecularWeight: 528.42866

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4)Cl)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4)Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O5S2/c22-17-11-18(23)19(33(28,29)26-6-8-30-9-7-26)10-16(17)20(27)31-12-15-13-32-21(25-15)24-14-4-2-1-3-5-14/h1-5,10-11,13H,6-9,12H2,(H,24,25)