3-pyrrolidin-1-ylsulfonyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-pyrrolidin-1-ylsulfonyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-pyrrolidin-1-ylsulfonyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-(1-pyrrolidinylsulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-pyrrolidin-1-ylsulfonyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-pyrrolidinosulfonyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide Formula: C18H18N4O5S3 MolecularWeight: 466.55432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H18N4O5S3/c19-29(24,25)13-6-7-15-16(11-13)28-18(20-15)21-17(23)12-4-3-5-14(10-12)30(26,27)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9H2,(H2,19,24,25)(H,20,21,23)