3-(prop-2-ynylsulfamoyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3-(prop-2-ynylsulfamoyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3-(prop-2-ynylsulfamoyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3-(prop-2-ynylsulfamoyl)-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-(prop-2-ynylsulfamoyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3-(propargylsulfamoyl)-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)benzamide Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4

InChI

InChI=1S/C21H20N4O3S2/c1-2-10-22-30(27,28)17-7-5-6-15(13-17)20(26)23-16-8-9-18-19(14-16)29-21(24-18)25-11-3-4-12-25/h1,5-9,13-14,22H,3-4,10-12H2,(H,23,26)