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

Systemtic Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-4-(2-ethylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-4-[(2-ethyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-4-[(2-ethyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-4-(2-ethylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-4-(2-ethylpiperidino)sulfonyl-benzamide Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)CCC5=CC=CC=C54

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)CCC5=CC=CC=C54

InChI

InChI=1S/C25H27N3O3S2/c1-2-19-8-5-6-16-28(19)33(30,31)20-13-10-18(11-14-20)24(29)27-25-26-23-21-9-4-3-7-17(21)12-15-22(23)32-25/h3-4,7,9-11,13-14,19H,2,5-6,8,12,15-16H2,1H3,(H,26,27,29)