ethyl 2-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoylamino]benzoate

Systemtic Name: ethyl 2-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoylamino]benzoate Openeye Name: ethyl 2-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoylamino]benzoate CAS Name: 2-[[[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoylamino]benzoate Traditional Name: 2-[(6-mesyl-1,3-benzothiazol-2-yl)carbamoylamino]benzoic acid ethyl ester Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H17N3O5S2/c1-3-26-16(22)12-6-4-5-7-13(12)19-17(23)21-18-20-14-9-8-11(28(2,24)25)10-15(14)27-18/h4-10H,3H2,1-2H3,(H2,19,20,21,23)