N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(C1)(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H29N3O6S/c29-23-16-28(11-10-26-23)35(31,32)20-5-3-4-18(14-20)24(30)27-17-25(8-1-2-9-25)19-6-7-21-22(15-19)34-13-12-33-21/h3-7,14-15H,1-2,8-13,16-17H2,(H,26,29)(H,27,30)