4-methoxy-3-[(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate

Systemtic Name: 4-methoxy-3-[(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Openeye Name: 4-methoxy-3-[(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate CAS Name: 4-methoxy-3-[[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]sulfamoyl]benzoate IUPAC Name: 4-methoxy-3-[(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Traditional Name: 4-methoxy-3-[(2-pyrrolidino-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Formula: C19H18N3O5S2- MolecularWeight: 432.49332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

InChI

InChI=1S/C19H19N3O5S2/c1-27-15-7-4-12(18(23)24)10-17(15)29(25,26)21-13-5-6-14-16(11-13)28-19(20-14)22-8-2-3-9-22/h4-7,10-11,21H,2-3,8-9H2,1H3,(H,23,24)/p-1