2-[4-[3-(2-tert-butylphenothiazin-10-yl)propyl]piperazin-1-yl]ethanol hydrate tetrahydrochloride

Systemtic Name: 2-[4-[3-(2-tert-butylphenothiazin-10-yl)propyl]piperazin-1-yl]ethanol hydrate tetrahydrochloride Openeye Name: 2-[4-[3-(2-tert-butylphenothiazin-10-yl)propyl]piperazin-1-yl]ethanol hydrate tetrahydrochloride CAS Name: 2-[4-[3-(2-tert-butyl-10-phenothiazinyl)propyl]-1-piperazinyl]ethanol hydrate tetrahydrochloride IUPAC Name: 2-[4-[3-(2-tert-butylphenothiazin-10-yl)propyl]piperazin-1-yl]ethanol hydrate tetrahydrochloride Traditional Name: 2-[4-[3-(2-tert-butylphenothiazin-10-yl)propyl]piperazino]ethanol hydrate tetrahydrochloride Formula: C50H76Cl4N6O3S2 MolecularWeight: 1015.11884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO.CC(C)(C)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO.O.Cl.Cl.Cl.Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO.CC(C)(C)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO.O.Cl.Cl.Cl.Cl

InChI

InChI=1S/2C25H35N3OS.4ClH.H2O/c2*1-25(2,3)20-9-10-24-22(19-20)28(21-7-4-5-8-23(21)30-24)12-6-11-26-13-15-27(16-14-26)17-18-29;;;;;/h2*4-5,7-10,19,29H,6,11-18H2,1-3H3;4*1H;1H2