6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-phenylpiperazin-1-yl)hexan-1-one

Systemtic Name: 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-phenylpiperazin-1-yl)hexan-1-one Openeye Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-(4-phenylpiperazin-1-yl)hexan-1-one CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-(4-phenyl-1-piperazinyl)-1-hexanone IUPAC Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-(4-phenylpiperazin-1-yl)hexan-1-one Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-1-(4-phenylpiperazino)hexan-1-one Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCCCNC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCCCNC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C23H28N4O3S/c28-22(27-17-15-26(16-18-27)19-9-3-1-4-10-19)13-5-2-8-14-24-23-20-11-6-7-12-21(20)31(29,30)25-23/h1,3-4,6-7,9-12H,2,5,8,13-18H2,(H,24,25)