ethyl 3-[[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]carbamoylamino]propanoate

Systemtic Name: ethyl 3-[[2-(methylsulfonylamino)-1,3-benzothiazol-6-yl]carbamoylamino]propanoate Openeye Name: ethyl 3-[[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]carbamoylamino]propanoate CAS Name: 3-[[[[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]amino]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]carbamoylamino]propanoate Traditional Name: 3-[[2-(methanesulfonamido)-1,3-benzothiazol-6-yl]carbamoylamino]propionic acid ethyl ester Formula: C14H18N4O5S2 MolecularWeight: 386.44652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)NC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCNC(=O)NC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C

InChI

InChI=1S/C14H18N4O5S2/c1-3-23-12(19)6-7-15-13(20)16-9-4-5-10-11(8-9)24-14(17-10)18-25(2,21)22/h4-5,8H,3,6-7H2,1-2H3,(H,17,18)(H2,15,16,20)