ethyl 2-[2-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbonylimino-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbonylimino-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[4-[benzyl(methyl)sulfamoyl]benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-[benzyl(methyl)sulfamoyl]benzoyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[4-[benzyl(methyl)sulfamoyl]benzoyl]imino-6-mesyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C27H27N3O7S3 MolecularWeight: 601.71418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O7S3/c1-4-37-25(31)18-30-23-15-14-22(39(3,33)34)16-24(23)38-27(30)28-26(32)20-10-12-21(13-11-20)40(35,36)29(2)17-19-8-6-5-7-9-19/h5-16H,4,17-18H2,1-3H3