2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl 2-[carbamimidoyl(methyl)amino]ethanoate

Systemtic Name: 2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl 2-[carbamimidoyl(methyl)amino]ethanoate Openeye Name: 2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl 2-[carbamimidoyl(methyl)amino]acetate CAS Name: 2-[carbamimidoyl(methyl)amino]acetic acid 2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl ester IUPAC Name: 2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl 2-[carbamimidoyl(methyl)amino]acetate Traditional Name: 2-[amidino(methyl)amino]acetic acid 2-[(2-sulfamoyl-1,3-benzothiazol-6-yl)oxy]ethyl ester Formula: C13H17N5O5S2 MolecularWeight: 387.43458

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCCOC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N)C(=N)N

Isomeric SMILES

CN(CC(=O)OCCOC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N)C(=N)N

InChI

InChI=1S/C13H17N5O5S2/c1-18(12(14)15)7-11(19)23-5-4-22-8-2-3-9-10(6-8)24-13(17-9)25(16,20)21/h2-3,6H,4-5,7H2,1H3,(H3,14,15)(H2,16,20,21)