2-[4-[4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride

Systemtic Name: 2-[4-[4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride Openeye Name: 2-[4-[4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]-1-piperidyl]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride CAS Name: 2-[4-[4-[[1-[(4-fluorophenyl)methyl]-2-benzimidazolyl]amino]-1-piperidinyl]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride IUPAC Name: 2-[4-[4-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]amino]piperidin-1-yl]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride Traditional Name: 2-[4-[4-[[1-(4-fluorobenzyl)benzimidazol-2-yl]amino]piperidino]butyl]-4H-1,4-benzothiazin-3-one dihydrochloride Formula: C31H36Cl2FN5OS MolecularWeight: 616.619843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCCCC5C(=O)NC6=CC=CC=C6S5.Cl.Cl

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCCCC5C(=O)NC6=CC=CC=C6S5.Cl.Cl

InChI

InChI=1S/C31H34FN5OS.2ClH/c32-23-14-12-22(13-15-23)21-37-27-9-3-1-7-25(27)35-31(37)33-24-16-19-36(20-17-24)18-6-5-11-29-30(38)34-26-8-2-4-10-28(26)39-29;;/h1-4,7-10,12-15,24,29H,5-6,11,16-21H2,(H,33,35)(H,34,38);2*1H