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

Systemtic Name: ethyl 3-ethyl-2-[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[4-[benzyl(ethyl)sulfamoyl]benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 3-ethyl-2-[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[benzyl(ethyl)sulfamoyl]benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[4-[benzyl(ethyl)sulfamoyl]benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C28H29N3O5S2 MolecularWeight: 551.67696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC)CC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O5S2/c1-4-30(19-20-10-8-7-9-11-20)38(34,35)23-15-12-21(13-16-23)26(32)29-28-31(5-2)24-17-14-22(18-25(24)37-28)27(33)36-6-3/h7-18H,4-6,19H2,1-3H3