2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-ethanoylpiperazin-1-yl)hexan-1-one

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-ethanoylpiperazin-1-yl)hexan-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexan-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-hexanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexan-1-one Traditional Name: 1-(4-acetylpiperazino)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexan-1-one Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N1CCN(CC1)C(=O)C)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCC(C(=O)N1CCN(CC1)C(=O)C)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H26N4O4S/c1-3-4-8-16(19(25)23-12-10-22(11-13-23)14(2)24)20-18-15-7-5-6-9-17(15)28(26,27)21-18/h5-7,9,16H,3-4,8,10-13H2,1-2H3,(H,20,21)