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

Systemtic Name: methyl 3-ethyl-2-[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C27H27N3O5S2 MolecularWeight: 537.65038

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C27H27N3O5S2/c1-4-29(18-19-9-7-6-8-10-19)37(33,34)22-14-11-20(12-15-22)25(31)28-27-30(5-2)23-16-13-21(26(32)35-3)17-24(23)36-27/h6-17H,4-5,18H2,1-3H3