methyl 2-[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C25H23N3O5S2 MolecularWeight: 509.59722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H23N3O5S2/c1-3-28(16-17-7-5-4-6-8-17)35(31,32)20-12-9-18(10-13-20)23(29)27-25-26-21-14-11-19(24(30)33-2)15-22(21)34-25/h4-15H,3,16H2,1-2H3,(H,26,27,29)