5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(diethylsulfamoyl)-N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-pyrrolidino-benzamide Formula: C26H30N4O3S2 MolecularWeight: 510.6714

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=NC4=C(S3)CCC5=CC=CC=C54

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=NC4=C(S3)CCC5=CC=CC=C54

InChI

InChI=1S/C26H30N4O3S2/c1-3-30(4-2)35(32,33)19-12-13-22(29-15-7-8-16-29)21(17-19)25(31)28-26-27-24-20-10-6-5-9-18(20)11-14-23(24)34-26/h5-6,9-10,12-13,17H,3-4,7-8,11,14-16H2,1-2H3,(H,27,28,31)